(4-bromophenyl)methyl-[(4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[(4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[(4-cyclopropyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[(4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[(4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: (4-bromobenzyl)-[(4-cyclopropyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium Formula: C15H20BrN4S+ MolecularWeight: 368.3151

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1C2CC2)C[NH+](C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=NN(C(=S)N1C2CC2)C[NH+](C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C15H19BrN4S/c1-11-17-19(15(21)20(11)14-7-8-14)10-18(2)9-12-3-5-13(16)6-4-12/h3-6,14H,7-10H2,1-2H3/p+1