2-chloranyl-3-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-7-methyl-quinoline

Systemtic Name: 2-chloranyl-3-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-7-methyl-quinoline Openeye Name: 3-[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-chloro-7-methyl-quinoline CAS Name: 2-chloro-3-[[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]methyl]-7-methylquinoline IUPAC Name: 2-chloro-3-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-7-methylquinoline Traditional Name: 3-[[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]methyl]-2-chloro-7-methyl-quinoline Formula: C23H21ClN4OS MolecularWeight: 436.95704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)CSC3=NN=C(N3CC=C)C4=CC=CC=C4OC)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)CSC3=NN=C(N3CC=C)C4=CC=CC=C4OC)Cl

InChI

InChI=1S/C23H21ClN4OS/c1-4-11-28-22(18-7-5-6-8-20(18)29-3)26-27-23(28)30-14-17-13-16-10-9-15(2)12-19(16)25-21(17)24/h4-10,12-13H,1,11,14H2,2-3H3