[(4S)-4-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)pentyl]-diethyl-azanium Openeye Name: [(4S)-4-(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)pentyl]-diethyl-ammonium CAS Name: [(4S)-4-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)pentyl]-diethylammonium IUPAC Name: [(4S)-4-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)pentyl]-diethylazanium Traditional Name: [(4S)-4-(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)pentyl]-diethyl-ammonium Formula: C14H27N4S+ MolecularWeight: 283.45598

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)N1C(=NNC1=S)C2CC2

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)N1C(=NNC1=S)C2CC2

InChI

InChI=1S/C14H26N4S/c1-4-17(5-2)10-6-7-11(3)18-13(12-8-9-12)15-16-14(18)19/h11-12H,4-10H2,1-3H3,(H,16,19)/p+1/t11-/m0/s1