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

Systemtic Name: 1-[[2-(butylcarbamothioylamino)-1,3-thiazol-4-yl]carbonylamino]-1-phenyl-thiourea Openeye Name: 1-[[2-(butylcarbamothioylamino)thiazole-4-carbonyl]amino]-1-phenyl-thiourea CAS Name: 1-[[[2-[[butylamino(sulfanylidene)methyl]amino]-4-thiazolyl]-oxomethyl]amino]-1-phenylthiourea IUPAC Name: 1-[[2-(butylcarbamothioylamino)-1,3-thiazole-4-carbonyl]amino]-1-phenylthiourea Traditional Name: 1-[[2-(butylthiocarbamoylamino)thiazole-4-carbonyl]amino]-1-phenyl-thiourea Formula: C16H20N6OS3 MolecularWeight: 408.5646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=NC(=CS1)C(=O)NN(C2=CC=CC=C2)C(=S)N

Isomeric SMILES

CCCCNC(=S)NC1=NC(=CS1)C(=O)NN(C2=CC=CC=C2)C(=S)N

InChI

InChI=1S/C16H20N6OS3/c1-2-3-9-18-15(25)20-16-19-12(10-26-16)13(23)21-22(14(17)24)11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3,(H2,17,24)(H,21,23)(H2,18,19,20,25)