5,6-dimethyl-2-[3-[methyl(3-thiophen-3-ylpropyl)amino]propyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 5,6-dimethyl-2-[3-[methyl(3-thiophen-3-ylpropyl)amino]propyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 5,6-dimethyl-2-[3-[methyl-[3-(3-thienyl)propyl]amino]propyl]-3,4-dihydroisoquinolin-1-one CAS Name: 5,6-dimethyl-2-[3-[methyl-[3-(3-thiophenyl)propyl]amino]propyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 5,6-dimethyl-2-[3-[methyl(3-thiophen-3-ylpropyl)amino]propyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 5,6-dimethyl-2-[3-[methyl-[3-(3-thienyl)propyl]amino]propyl]-3,4-dihydroisocarbostyril Formula: C22H30N2OS MolecularWeight: 370.5514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)N(CC2)CCCN(C)CCCC3=CSC=C3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)N(CC2)CCCN(C)CCCC3=CSC=C3)C

InChI

InChI=1S/C22H30N2OS/c1-17-7-8-21-20(18(17)2)9-14-24(22(21)25)13-5-12-23(3)11-4-6-19-10-15-26-16-19/h7-8,10,15-16H,4-6,9,11-14H2,1-3H3