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

Systemtic Name: [(1S)-2,3-dihydro-1H-inden-1-yl]-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-[(1S)-indan-1-yl]-methyl-ammonium CAS Name: [(1S)-2,3-dihydro-1H-inden-1-yl]-methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: [(1S)-2,3-dihydro-1H-inden-1-yl]-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-[(1S)-indan-1-yl]-methyl-ammonium Formula: C17H23N4S+ MolecularWeight: 315.45632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1CC=C)C[NH+](C)C2CCC3=CC=CC=C23

Isomeric SMILES

CC1=NN(C(=S)N1CC=C)C[NH+](C)[C@H]2CCC3=CC=CC=C23

InChI

InChI=1S/C17H22N4S/c1-4-11-20-13(2)18-21(17(20)22)12-19(3)16-10-9-14-7-5-6-8-15(14)16/h4-8,16H,1,9-12H2,2-3H3/p+1/t16-/m0/s1