N-[3-[1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-4-methyl-benzamide

Systemtic Name: N-[3-[1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-4-methyl-benzamide Openeye Name: N-[3-[1-[(2-ethyl-6-methyl-phenyl)carbamoyl]propylsulfanyl]phenyl]-4-methyl-benzamide CAS Name: N-[3-[[1-(2-ethyl-6-methylanilino)-1-oxobutan-2-yl]thio]phenyl]-4-methylbenzamide IUPAC Name: N-[3-[1-(2-ethyl-6-methylanilino)-1-oxobutan-2-yl]sulfanylphenyl]-4-methylbenzamide Traditional Name: N-[3-[1-[(2-ethyl-6-methyl-phenyl)carbamoyl]propylthio]phenyl]-4-methyl-benzamide Formula: C27H30N2O2S MolecularWeight: 446.6043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C27H30N2O2S/c1-5-20-10-7-9-19(4)25(20)29-27(31)24(6-2)32-23-12-8-11-22(17-23)28-26(30)21-15-13-18(3)14-16-21/h7-17,24H,5-6H2,1-4H3,(H,28,30)(H,29,31)