(4-cyclopropyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(1S)-2,3-dihydro-1H-inden-1-yl]-methyl-azanium

Systemtic Name: (4-cyclopropyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(1S)-2,3-dihydro-1H-inden-1-yl]-methyl-azanium Openeye Name: [4-cyclopropyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-[(1S)-indan-1-yl]-methyl-ammonium CAS Name: [4-cyclopropyl-3-(3-pyridinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1S)-2,3-dihydro-1H-inden-1-yl]-methylammonium IUPAC Name: (4-cyclopropyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(1S)-2,3-dihydro-1H-inden-1-yl]-methylazanium Traditional Name: [4-cyclopropyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-[(1S)-indan-1-yl]-methyl-ammonium Formula: C21H24N5S+ MolecularWeight: 378.51376

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CN1C(=S)N(C(=N1)C2=CN=CC=C2)C3CC3)C4CCC5=CC=CC=C45

Isomeric SMILES

C[NH+](CN1C(=S)N(C(=N1)C2=CN=CC=C2)C3CC3)[C@H]4CCC5=CC=CC=C45

InChI

InChI=1S/C21H23N5S/c1-24(19-11-8-15-5-2-3-7-18(15)19)14-25-21(27)26(17-9-10-17)20(23-25)16-6-4-12-22-13-16/h2-7,12-13,17,19H,8-11,14H2,1H3/p+1/t19-/m0/s1