1-cyclohexyl-3-[3-[(4-propan-2-yloxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]thiourea

Systemtic Name: 1-cyclohexyl-3-[3-[(4-propan-2-yloxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]thiourea Openeye Name: 1-cyclohexyl-3-[3-[(4-isopropoxyphenyl)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]thiourea CAS Name: 1-cyclohexyl-3-[3-[(4-propan-2-yloxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]thiourea IUPAC Name: 1-cyclohexyl-3-[3-[(4-propan-2-yloxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]thiourea Traditional Name: 1-cyclohexyl-3-[3-(4-isopropoxybenzyl)-5-thioxo-1H-1,2,4-triazol-4-yl]thiourea Formula: C19H27N5OS2 MolecularWeight: 405.58058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CC2=NNC(=S)N2NC(=S)NC3CCCCC3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CC2=NNC(=S)N2NC(=S)NC3CCCCC3

InChI

InChI=1S/C19H27N5OS2/c1-13(2)25-16-10-8-14(9-11-16)12-17-21-22-19(27)24(17)23-18(26)20-15-6-4-3-5-7-15/h8-11,13,15H,3-7,12H2,1-2H3,(H,22,27)(H2,20,23,26)