6-chloranyl-2-[3-[(4-methyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6-chloranyl-2-[3-[(4-methyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 6-chloro-2-[3-[[4-methyl-5-(3-thienyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-3,4-dihydro-1H-isoquinoline CAS Name: 6-chloro-2-[3-[[4-methyl-5-(3-thiophenyl)-1,2,4-triazol-3-yl]thio]propyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6-chloro-2-[3-[(4-methyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 6-chloro-2-[3-[[4-methyl-5-(3-thienyl)-1,2,4-triazol-3-yl]thio]propyl]-3,4-dihydro-1H-isoquinoline Formula: C19H21ClN4S2 MolecularWeight: 404.97984

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCN2CCC3=C(C2)C=CC(=C3)Cl)C4=CSC=C4

Isomeric SMILES

CN1C(=NN=C1SCCCN2CCC3=C(C2)C=CC(=C3)Cl)C4=CSC=C4

InChI

InChI=1S/C19H21ClN4S2/c1-23-18(16-6-10-25-13-16)21-22-19(23)26-9-2-7-24-8-5-14-11-17(20)4-3-15(14)12-24/h3-4,6,10-11,13H,2,5,7-9,12H2,1H3