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

Systemtic Name: 5,6-dimethyl-2-[3-[methyl(4-thiophen-2-ylbutyl)amino]propyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 5,6-dimethyl-2-[3-[methyl-[4-(2-thienyl)butyl]amino]propyl]-3,4-dihydroisoquinolin-1-one CAS Name: 5,6-dimethyl-2-[3-[methyl(4-thiophen-2-ylbutyl)amino]propyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 5,6-dimethyl-2-[3-[methyl(4-thiophen-2-ylbutyl)amino]propyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 5,6-dimethyl-2-[3-[methyl-[4-(2-thienyl)butyl]amino]propyl]-3,4-dihydroisocarbostyril Formula: C23H32N2OS MolecularWeight: 384.57798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)N(CC2)CCCN(C)CCCCC3=CC=CS3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)N(CC2)CCCN(C)CCCCC3=CC=CS3)C

InChI

InChI=1S/C23H32N2OS/c1-18-10-11-22-21(19(18)2)12-16-25(23(22)26)15-7-14-24(3)13-5-4-8-20-9-6-17-27-20/h6,9-11,17H,4-5,7-8,12-16H2,1-3H3