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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NNC(=S)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NNC(=S)NCCC2=CC(=C(C=C2)OC)OC

InChI

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