3-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(2-methylpropyl)-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(2-methylpropyl)-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-isobutyl-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(2-methylpropyl)-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(2-methylpropyl)-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-isobutyl-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN(C1=S)CN2CCC3=CC=CC=C3C2)CCC(=O)N

Isomeric SMILES

CC(C)CN1C(=NN(C1=S)CN2CCC3=CC=CC=C3C2)CCC(=O)N

InChI

InChI=1S/C19H27N5OS/c1-14(2)11-23-18(8-7-17(20)25)21-24(19(23)26)13-22-10-9-15-5-3-4-6-16(15)12-22/h3-6,14H,7-13H2,1-2H3,(H2,20,25)