1-[[2-(cyclohexylcarbamothioylamino)-1,3-thiazol-4-yl]carbonylamino]-1-phenyl-thiourea

Systemtic Name: 1-[[2-(cyclohexylcarbamothioylamino)-1,3-thiazol-4-yl]carbonylamino]-1-phenyl-thiourea Openeye Name: 1-[[2-(cyclohexylcarbamothioylamino)thiazole-4-carbonyl]amino]-1-phenyl-thiourea CAS Name: 1-[[[2-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-4-thiazolyl]-oxomethyl]amino]-1-phenylthiourea IUPAC Name: 1-[[2-(cyclohexylcarbamothioylamino)-1,3-thiazole-4-carbonyl]amino]-1-phenylthiourea Traditional Name: 1-[[2-(cyclohexylthiocarbamoylamino)thiazole-4-carbonyl]amino]-1-phenyl-thiourea Formula: C18H22N6OS3 MolecularWeight: 434.60188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=NC(=CS2)C(=O)NN(C3=CC=CC=C3)C(=S)N

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=NC(=CS2)C(=O)NN(C3=CC=CC=C3)C(=S)N

InChI

InChI=1S/C18H22N6OS3/c19-16(26)24(13-9-5-2-6-10-13)23-15(25)14-11-28-18(21-14)22-17(27)20-12-7-3-1-4-8-12/h2,5-6,9-12H,1,3-4,7-8H2,(H2,19,26)(H,23,25)(H2,20,21,22,27)