N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(1,3-dithian-2-yl)benzamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(1,3-dithian-2-yl)benzamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(1,3-dithian-2-yl)benzamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(1,3-dithian-2-yl)benzamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(1,3-dithian-2-yl)benzamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(1,3-dithian-2-yl)benzamide Formula: C24H30N2OS2 MolecularWeight: 426.6378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=CC=C(C=C1)C2SCCCS2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(CNC(=O)C1=CC=C(C=C1)C2SCCCS2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H30N2OS2/c1-2-22(26-13-12-18-6-3-4-7-21(18)17-26)16-25-23(27)19-8-10-20(11-9-19)24-28-14-5-15-29-24/h3-4,6-11,22,24H,2,5,12-17H2,1H3,(H,25,27)