2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(S)-p-tolyl(2-thienyl)methyl]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(S)-p-tolyl(2-thienyl)methyl]acetamide Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H18N2O2S2/c1-14-8-10-15(11-9-14)20(18-7-4-12-26-18)23-19(24)13-27-21-22-16-5-2-3-6-17(16)25-21/h2-12,20H,13H2,1H3,(H,23,24)/t20-/m0/s1