methyl (2S)-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C19H16ClNO3S MolecularWeight: 373.85324

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C19H16ClNO3S/c1-24-19(23)14(11-12-7-3-2-4-8-12)21-18(22)17-16(20)13-9-5-6-10-15(13)25-17/h2-10,14H,11H2,1H3,(H,21,22)/t14-/m0/s1