1-(1-benzothiophen-3-ylmethyl)-5-methyl-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(1-benzothiophen-3-ylmethyl)-5-methyl-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-(benzothiophen-3-ylmethyl)-5-methyl-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)triazole-4-carboxamide CAS Name: 1-(1-benzothiophen-3-ylmethyl)-5-methyl-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)-4-triazolecarboxamide IUPAC Name: 1-(1-benzothiophen-3-ylmethyl)-5-methyl-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)triazole-4-carboxamide Traditional Name: 1-(benzothiophen-3-ylmethyl)-5-methyl-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)triazole-4-carboxamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1CC2=CSC3=CC=CC=C32)C(=O)NC4=CC5=C(CNCC5)C=C4

Isomeric SMILES

CC1=C(N=NN1CC2=CSC3=CC=CC=C32)C(=O)NC4=CC5=C(CNCC5)C=C4

InChI

InChI=1S/C22H21N5OS/c1-14-21(22(28)24-18-7-6-16-11-23-9-8-15(16)10-18)25-26-27(14)12-17-13-29-20-5-3-2-4-19(17)20/h2-7,10,13,23H,8-9,11-12H2,1H3,(H,24,28)