N-[3-[1-[(2,5-dimethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[3-[1-[(2,5-dimethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-2,6-dimethoxy-benzamide Openeye Name: N-[3-[1-[(2,5-dimethoxyphenyl)carbamoyl]propylsulfanyl]phenyl]-2,6-dimethoxy-benzamide CAS Name: N-[3-[[1-(2,5-dimethoxyanilino)-1-oxobutan-2-yl]thio]phenyl]-2,6-dimethoxybenzamide IUPAC Name: N-[3-[1-(2,5-dimethoxyanilino)-1-oxobutan-2-yl]sulfanylphenyl]-2,6-dimethoxybenzamide Traditional Name: N-[3-[1-[(2,5-dimethoxyphenyl)carbamoyl]propylthio]phenyl]-2,6-dimethoxy-benzamide Formula: C27H30N2O6S MolecularWeight: 510.6019

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)OC)OC)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)OC)OC)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C27H30N2O6S/c1-6-24(26(30)29-20-16-18(32-2)13-14-21(20)33-3)36-19-10-7-9-17(15-19)28-27(31)25-22(34-4)11-8-12-23(25)35-5/h7-16,24H,6H2,1-5H3,(H,28,31)(H,29,30)