1-(3,4-dimethylphenyl)-3-(phenethylcarbamothioylamino)thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-(phenethylcarbamothioylamino)thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-(phenethylcarbamothioylamino)thiourea CAS Name: 1-[[(3,4-dimethylanilino)-sulfanylidenemethyl]amino]-3-phenethylthiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-(phenethylcarbamothioylamino)thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-(phenethylthiocarbamoylamino)thiourea Formula: C18H22N4S2 MolecularWeight: 358.52408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4S2/c1-13-8-9-16(12-14(13)2)20-18(24)22-21-17(23)19-11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H2,19,21,23)(H2,20,22,24)