N-[2-[(3,4-dimethoxyphenyl)carbothioylamino]ethyl]-3,4-dimethoxy-benzenecarbothioamide

Systemtic Name: N-[2-[(3,4-dimethoxyphenyl)carbothioylamino]ethyl]-3,4-dimethoxy-benzenecarbothioamide Openeye Name: N-[2-[(3,4-dimethoxybenzenecarbothioyl)amino]ethyl]-3,4-dimethoxy-benzenecarbothioamide CAS Name: N-[2-[[(3,4-dimethoxyphenyl)-sulfanylidenemethyl]amino]ethyl]-3,4-dimethoxybenzenecarbothioamide IUPAC Name: N-[2-[(3,4-dimethoxybenzenecarbothioyl)amino]ethyl]-3,4-dimethoxybenzenecarbothioamide Traditional Name: N-[2-[(3,4-dimethoxythiobenzoyl)amino]ethyl]-3,4-dimethoxy-thiobenzamide Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=S)NCCNC(=S)C2=CC(=C(C=C2)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=S)NCCNC(=S)C2=CC(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C20H24N2O4S2/c1-23-15-7-5-13(11-17(15)25-3)19(27)21-9-10-22-20(28)14-6-8-16(24-2)18(12-14)26-4/h5-8,11-12H,9-10H2,1-4H3,(H,21,27)(H,22,28)