3-chloranyl-4-methyl-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline

Systemtic Name: 3-chloranyl-4-methyl-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-chloro-4-methyl-quinoline CAS Name: 3-chloro-4-methyl-2-[[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]quinoline IUPAC Name: 3-chloro-4-methyl-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Traditional Name: 2-[[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-3-chloro-4-methyl-quinoline Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3CC=C)C)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3CC=C)C)Cl

InChI

InChI=1S/C17H17ClN4S/c1-4-9-22-12(3)20-21-17(22)23-10-15-16(18)11(2)13-7-5-6-8-14(13)19-15/h4-8H,1,9-10H2,2-3H3