3-[4-(1,5-dimethyl-3-sulfanylidene-1,2,4-triazolidin-4-yl)butyl]-1,1-diethyl-thiourea

Systemtic Name: 3-[4-(1,5-dimethyl-3-sulfanylidene-1,2,4-triazolidin-4-yl)butyl]-1,1-diethyl-thiourea Openeye Name: 3-[4-(1,5-dimethyl-3-thioxo-1,2,4-triazolidin-4-yl)butyl]-1,1-diethyl-thiourea CAS Name: 3-[4-(1,5-dimethyl-3-sulfanylidene-1,2,4-triazolidin-4-yl)butyl]-1,1-diethylthiourea IUPAC Name: 3-[4-(1,5-dimethyl-3-sulfanylidene-1,2,4-triazolidin-4-yl)butyl]-1,1-diethylthiourea Traditional Name: 3-[4-(1,5-dimethyl-3-thioxo-1,2,4-triazolidin-4-yl)butyl]-1,1-diethyl-thiourea Formula: C13H27N5S2 MolecularWeight: 317.51698

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)NCCCCN1C(N(NC1=S)C)C

Isomeric SMILES

CCN(CC)C(=S)NCCCCN1C(N(NC1=S)C)C

InChI

InChI=1S/C13H27N5S2/c1-5-17(6-2)12(19)14-9-7-8-10-18-11(3)16(4)15-13(18)20/h11H,5-10H2,1-4H3,(H,14,19)(H,15,20)