N-[[2-methyl-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-phenoxy-ethanamide

Systemtic Name: N-[[2-methyl-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[[2-methyl-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[2-methyl-5-(6-methyl-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[[2-methyl-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[[2-methyl-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]-2-phenoxy-acetamide Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C24H21N3O3S/c1-15-8-11-19-21(12-15)30-23(25-19)17-10-9-16(2)20(13-17)26-24(31)27-22(28)14-29-18-6-4-3-5-7-18/h3-13H,14H2,1-2H3,(H2,26,27,28,31)