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

Systemtic Name: 1-butyl-3-[[2-(cyclohexylcarbamothioylamino)-1,3-thiazol-4-yl]carbonylamino]thiourea Openeye Name: 1-butyl-3-[[2-(cyclohexylcarbamothioylamino)thiazole-4-carbonyl]amino]thiourea CAS Name: 1-butyl-3-[[[2-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-4-thiazolyl]-oxomethyl]amino]thiourea IUPAC Name: 1-butyl-3-[[2-(cyclohexylcarbamothioylamino)-1,3-thiazole-4-carbonyl]amino]thiourea Traditional Name: 1-butyl-3-[[2-(cyclohexylthiocarbamoylamino)thiazole-4-carbonyl]amino]thiourea Formula: C16H26N6OS3 MolecularWeight: 414.61224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)C1=CSC(=N1)NC(=S)NC2CCCCC2

Isomeric SMILES

CCCCNC(=S)NNC(=O)C1=CSC(=N1)NC(=S)NC2CCCCC2

InChI

InChI=1S/C16H26N6OS3/c1-2-3-9-17-14(24)22-21-13(23)12-10-26-16(19-12)20-15(25)18-11-7-5-4-6-8-11/h10-11H,2-9H2,1H3,(H,21,23)(H2,17,22,24)(H2,18,19,20,25)