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

Systemtic Name: methyl (2S)-2-[(3-methyl-1-benzothiophen-2-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(3-methylbenzothiophene-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(3-methyl-1-benzothiophen-2-yl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3-methyl-1-benzothiophene-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(3-methylbenzothiophene-2-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H19NO3S/c1-13-15-10-6-7-11-17(15)25-18(13)19(22)21-16(20(23)24-2)12-14-8-4-3-5-9-14/h3-11,16H,12H2,1-2H3,(H,21,22)/t16-/m0/s1