(diphenylmethyl)-methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium

Systemtic Name: (diphenylmethyl)-methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: (4-allyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-benzhydryl-methyl-ammonium CAS Name: (diphenylmethyl)-methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: benzhydryl-methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: (4-allyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-benzhydryl-methyl-ammonium Formula: C21H25N4S+ MolecularWeight: 365.515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1CC=C)C[NH+](C)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=S)N1CC=C)C[NH+](C)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4S/c1-4-15-24-17(2)22-25(21(24)26)16-23(3)20(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h4-14,20H,1,15-16H2,2-3H3/p+1