(4-cyclopropyl-3-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-(diphenylmethyl)-methyl-azanium

Systemtic Name: (4-cyclopropyl-3-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-(diphenylmethyl)-methyl-azanium Openeye Name: benzhydryl-[(4-cyclopropyl-3-isopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: (4-cyclopropyl-3-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-(diphenylmethyl)-methylammonium IUPAC Name: benzhydryl-[(4-cyclopropyl-3-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: benzhydryl-[(4-cyclopropyl-3-isopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium Formula: C23H29N4S+ MolecularWeight: 393.56816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=S)N1C2CC2)C[NH+](C)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=NN(C(=S)N1C2CC2)C[NH+](C)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N4S/c1-17(2)22-24-26(23(28)27(22)20-14-15-20)16-25(3)21(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,17,20-21H,14-16H2,1-3H3/p+1