(2S)-4-(benzoylcarbamoyl)-2-[[4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzoyl]amino]butanoic acid
Molecular Formula:
C32H29N5O6
InChI: InChI=1/C32H29N5O6/c1-3-17-37(19-21-9-14-26-25(18-21)31(41)34-20(2)33-26)24-12-10-23(11-13-24)29(39)35-27(32(42)43)15-16-28(38)36-30(40)22-7-5-4-6-8-22/h1,4-14,18,27H,15-17,19H2,2H3,(H,35,39)(H,42,43)(H,33,34,41)(H,36,38,40)/t27-/m0/s1/f/h33,35-36,42H
InChIKey: InChIKey=PQHWPVRSJHWLSW-KFMMQBIEDM
SMILES: CC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CC#C)C3=CC=C(C=C3)C(=O)NC(CCC(=O)NC(=O)C4=CC=CC=C4)C(=O)O
Names:
(2S)-4-(benzoylcarbamoyl)-2-[[4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzoyl]amino]butanoic acid
Registries:
PubChem CID 10348215
PubChem ID 15359707
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