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3-[3-(4-pyrimidin-2-ylphenyl)propanoylamino]thiophene-2-carboxylic acid
3-[3-(4-pyrimidin-2-ylphenyl)propanoylamino]thiophene-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
C1=CN=C(N=C1)C2=CC=C(C=C2)CCC(=O)NC3=C(SC=C3)C(=O)O
Isomeric SMILES
C1=CN=C(N=C1)C2=CC=C(C=C2)CCC(=O)NC3=C(SC=C3)C(=O)O
InChI
InChI=1S/C18H15N3O3S/c22-15(21-14-8-11-25-16(14)18(23)24)7-4-12-2-5-13(6-3-12)17-19-9-1-10-20-17/h1-3,5-6,8-11H,4,7H2,(H,21,22)(H,23,24)
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- (2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[(2S,3R,4S,6R)-4-[2-[1-[(2S)-1-[4-[4-(aminomethyl)phenyl]phenyl]-3-fluoranyl-propan-2-yl]-1,2,3-triazol-4-yl]ethyl-methyl-amino]-6-methyl-3-oxidanyl-oxan-2-yl]oxy-2-ethyl-13-[(2R,4R,5S,6S)-4-methoxy-4,6-dimethyl-5-oxidanyl-oxan-2-yl]oxy-3,5,6,8,10,12,14-heptamethyl-3,4,10-tris(oxidanyl)-1-oxa-6-azacyclopentadecan-15-one
- (2S)-1-[4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenyl]phenyl]carbonylpiperidine-2-carboxylic acid
- (2S)-1-[4-[4-[(3,4-dimethylphenyl)carbamoylamino]phenyl]phenyl]carbonylpiperidine-2-carboxylic acid
