3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(4-phenylbutan-2-yl)benzamide

Systemtic Name: 3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(4-phenylbutan-2-yl)benzamide Openeye Name: 3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(1-methyl-3-phenyl-propyl)benzamide CAS Name: 3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(4-phenylbutan-2-yl)benzamide IUPAC Name: 3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(4-phenylbutan-2-yl)benzamide Traditional Name: 3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(1-methyl-3-phenyl-propyl)benzamide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)NC(C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)NC(C)CCC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O2S/c1-18-8-6-13-23-24(18)28-26(30-23)31-17-21-11-7-12-22(16-21)25(29)27-19(2)14-15-20-9-4-3-5-10-20/h3-13,16,19H,14-15,17H2,1-2H3,(H,27,29)