1-cyclohexa-1,5-dien-1-yl-3-[2-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)ethyl]thiourea

Systemtic Name: 1-cyclohexa-1,5-dien-1-yl-3-[2-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)ethyl]thiourea Openeye Name: 1-cyclohexa-1,5-dien-1-yl-3-[2-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)ethyl]thiourea CAS Name: 1-(1-cyclohexa-1,5-dienyl)-3-[2-[[(1-cyclohexa-1,5-dienylamino)-sulfanylidenemethyl]amino]ethyl]thiourea IUPAC Name: 1-cyclohexa-1,5-dien-1-yl-3-[2-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)ethyl]thiourea Traditional Name: 1-cyclohexa-1,5-dien-1-yl-3-[2-(cyclohexa-1,5-dien-1-ylthiocarbamoylamino)ethyl]thiourea Formula: C16H22N4S2 MolecularWeight: 334.50268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C=C1)NC(=S)NCCNC(=S)NC2=CCCC=C2

Isomeric SMILES

C1CC=C(C=C1)NC(=S)NCCNC(=S)NC2=CCCC=C2

InChI

InChI=1S/C16H22N4S2/c21-15(19-13-7-3-1-4-8-13)17-11-12-18-16(22)20-14-9-5-2-6-10-14/h3,5,7-10H,1-2,4,6,11-12H2,(H2,17,19,21)(H2,18,20,22)