2-chloranyl-7-methoxy-3-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline

Systemtic Name: 2-chloranyl-7-methoxy-3-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 2-chloro-7-methoxy-3-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 2-chloro-7-methoxy-3-[[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 2-chloro-7-methoxy-3-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 2-chloro-7-methoxy-3-[[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]quinoline Formula: C18H15ClN4OS2 MolecularWeight: 402.9209

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)CSC3=NNC(=N3)CC4=CC=CS4)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)CSC3=NNC(=N3)CC4=CC=CS4)Cl

InChI

InChI=1S/C18H15ClN4OS2/c1-24-13-5-4-11-7-12(17(19)20-15(11)8-13)10-26-18-21-16(22-23-18)9-14-3-2-6-25-14/h2-8H,9-10H2,1H3,(H,21,22,23)