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

Systemtic Name: N-[(2S)-butan-2-yl]-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide Openeye Name: 3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[(1S)-1-methylpropyl]benzamide CAS Name: N-[(2S)-butan-2-yl]-3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]benzamide IUPAC Name: N-[(2S)-butan-2-yl]-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide Traditional Name: 3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-[(1S)-1-methylpropyl]benzamide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=CC=C1)CSC2=NC3=C(C=CC=C3O2)C

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=CC=C1)CSC2=NC3=C(C=CC=C3O2)C

InChI

InChI=1S/C20H22N2O2S/c1-4-14(3)21-19(23)16-9-6-8-15(11-16)12-25-20-22-18-13(2)7-5-10-17(18)24-20/h5-11,14H,4,12H2,1-3H3,(H,21,23)/t14-/m0/s1