3,4-dihydro-1H-isoquinolin-2-yl-[1-methyl-5-(3-methylsulfanylpropylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-methyl-5-(3-methylsulfanylpropylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-methyl-5-(3-methylsulfanylpropylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-methyl-5-[3-(methylthio)propylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-methyl-5-(3-methylsulfanylpropylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-methyl-5-[3-(methylthio)propylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCCCSC)C(=N1)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C2=C(CC(CC2)NCCCSC)C(=N1)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H30N4OS/c1-25-20-9-8-18(23-11-5-13-28-2)14-19(20)21(24-25)22(27)26-12-10-16-6-3-4-7-17(16)15-26/h3-4,6-7,18,23H,5,8-15H2,1-2H3