1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(3,5-dimethylanilino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-(homoveratrylthiocarbamoylamino)thiourea Formula: C20H26N4O2S2 MolecularWeight: 418.57604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NNC(=S)NCCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NNC(=S)NCCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C20H26N4O2S2/c1-13-9-14(2)11-16(10-13)22-20(28)24-23-19(27)21-8-7-15-5-6-17(25-3)18(12-15)26-4/h5-6,9-12H,7-8H2,1-4H3,(H2,21,23,27)(H2,22,24,28)