[3-(2-chlorophenyl)-4-cyclopentyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [3-(2-chlorophenyl)-4-cyclopentyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [3-(2-chlorophenyl)-4-cyclopentyl-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [3-(2-chlorophenyl)-4-cyclopentyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [3-(2-chlorophenyl)-4-cyclopentyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [3-(2-chlorophenyl)-4-cyclopentyl-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-(3-thenyl)ammonium Formula: C20H24ClN4S2+ MolecularWeight: 420.01436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CN2C(=S)N(C(=N2)C3=CC=CC=C3Cl)C4CCCC4

Isomeric SMILES

C[NH+](CC1=CSC=C1)CN2C(=S)N(C(=N2)C3=CC=CC=C3Cl)C4CCCC4

InChI

InChI=1S/C20H23ClN4S2/c1-23(12-15-10-11-27-13-15)14-24-20(26)25(16-6-2-3-7-16)19(22-24)17-8-4-5-9-18(17)21/h4-5,8-11,13,16H,2-3,6-7,12,14H2,1H3/p+1