1-cyclohexyl-3-[4-(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]thiourea

Systemtic Name: 1-cyclohexyl-3-[4-(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]thiourea Openeye Name: 1-cyclohexyl-3-[4-(4-ethyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]thiourea CAS Name: 1-cyclohexyl-3-[4-(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]thiourea IUPAC Name: 1-cyclohexyl-3-[4-(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]thiourea Traditional Name: 1-cyclohexyl-3-[4-(4-ethyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]thiourea Formula: C17H23N5S2 MolecularWeight: 361.52802

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)C2=CC=C(C=C2)NC(=S)NC3CCCCC3

Isomeric SMILES

CCN1C(=NNC1=S)C2=CC=C(C=C2)NC(=S)NC3CCCCC3

InChI

InChI=1S/C17H23N5S2/c1-2-22-15(20-21-17(22)24)12-8-10-14(11-9-12)19-16(23)18-13-6-4-3-5-7-13/h8-11,13H,2-7H2,1H3,(H,21,24)(H2,18,19,23)