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

Systemtic Name: 1-[[2-(cyclohexylcarbamothioylamino)-1,3-thiazol-4-yl]carbonylamino]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[[2-(cyclohexylcarbamothioylamino)thiazole-4-carbonyl]amino]thiourea CAS Name: 1-[[[2-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-4-thiazolyl]-oxomethyl]amino]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[[2-(cyclohexylcarbamothioylamino)-1,3-thiazole-4-carbonyl]amino]thiourea Traditional Name: 1-benzyl-1-[[2-(cyclohexylthiocarbamoylamino)thiazole-4-carbonyl]amino]thiourea Formula: C19H24N6OS3 MolecularWeight: 448.62846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=NC(=CS2)C(=O)NN(CC3=CC=CC=C3)C(=S)N

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=NC(=CS2)C(=O)NN(CC3=CC=CC=C3)C(=S)N

InChI

InChI=1S/C19H24N6OS3/c20-17(27)25(11-13-7-3-1-4-8-13)24-16(26)15-12-29-19(22-15)23-18(28)21-14-9-5-2-6-10-14/h1,3-4,7-8,12,14H,2,5-6,9-11H2,(H2,20,27)(H,24,26)(H2,21,22,23,28)