3-methyl-N-[[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[2-(o-tolyl)-1,3-benzoxazol-5-yl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[[2-(o-tolyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]butyramide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)CC(C)C

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)CC(C)C

InChI

InChI=1S/C20H21N3O2S/c1-12(2)10-18(24)23-20(26)21-14-8-9-17-16(11-14)22-19(25-17)15-7-5-4-6-13(15)3/h4-9,11-12H,10H2,1-3H3,(H2,21,23,24,26)