methyl (2R)-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C21H17ClN2O3S MolecularWeight: 412.88928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H17ClN2O3S/c1-27-21(26)16(10-12-11-23-15-8-4-2-6-13(12)15)24-20(25)19-18(22)14-7-3-5-9-17(14)28-19/h2-9,11,16,23H,10H2,1H3,(H,24,25)/t16-/m1/s1