2-chloranyl-3-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline

Systemtic Name: 2-chloranyl-3-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Openeye Name: 2-chloro-3-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline CAS Name: 2-chloro-3-[[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 2-chloro-3-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Traditional Name: 2-chloro-3-[[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]methyl]quinoline Formula: C19H20ClN5S MolecularWeight: 385.9136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(N2C3CC3)SCC4=CC5=CC=CC=C5N=C4Cl

Isomeric SMILES

C1CCN(C1)C2=NN=C(N2C3CC3)SCC4=CC5=CC=CC=C5N=C4Cl

InChI

InChI=1S/C19H20ClN5S/c20-17-14(11-13-5-1-2-6-16(13)21-17)12-26-19-23-22-18(24-9-3-4-10-24)25(19)15-7-8-15/h1-2,5-6,11,15H,3-4,7-10,12H2