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

Systemtic Name: N-[3-[1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-2,6-dimethoxy-benzamide Openeye Name: N-[3-[1-[(2-ethyl-6-methyl-phenyl)carbamoyl]propylsulfanyl]phenyl]-2,6-dimethoxy-benzamide CAS Name: N-[3-[[1-(2-ethyl-6-methylanilino)-1-oxobutan-2-yl]thio]phenyl]-2,6-dimethoxybenzamide IUPAC Name: N-[3-[1-(2-ethyl-6-methylanilino)-1-oxobutan-2-yl]sulfanylphenyl]-2,6-dimethoxybenzamide Traditional Name: N-[3-[1-[(2-ethyl-6-methyl-phenyl)carbamoyl]propylthio]phenyl]-2,6-dimethoxy-benzamide Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC)C

InChI

InChI=1S/C28H32N2O4S/c1-6-19-12-8-11-18(3)26(19)30-27(31)24(7-2)35-21-14-9-13-20(17-21)29-28(32)25-22(33-4)15-10-16-23(25)34-5/h8-17,24H,6-7H2,1-5H3,(H,29,32)(H,30,31)