N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2,4-dimethyl-benzamide Openeye Name: 2,4-dimethyl-N-[[2-methyl-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide CAS Name: N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]-2,4-dimethylbenzamide IUPAC Name: N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-2,4-dimethylbenzamide Traditional Name: 2,4-dimethyl-N-[[2-methyl-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]benzamide Formula: C28H29N3O2S MolecularWeight: 471.61376

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)C4=C(C=C(C=C4)C)C

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)C4=C(C=C(C=C4)C)C

InChI

InChI=1S/C28H29N3O2S/c1-6-17(3)20-10-12-25-24(14-20)29-27(33-25)21-9-8-18(4)23(15-21)30-28(34)31-26(32)22-11-7-16(2)13-19(22)5/h7-15,17H,6H2,1-5H3,(H2,30,31,32,34)