3-[(5-piperazin-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]benzamide

Systemtic Name: 3-[(5-piperazin-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]benzamide Openeye Name: 3-[(5-piperazin-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]benzamide CAS Name: 3-[[5-(1-piperazinyl)-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]benzamide IUPAC Name: 3-[(5-piperazin-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]benzamide Traditional Name: 3-[(5-piperazino-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]benzamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=CC=C2)N3CCNCC3)S(=O)(=O)C4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1CN(CC2=C1C(=CC=C2)N3CCNCC3)S(=O)(=O)C4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C20H24N4O3S/c21-20(25)15-3-1-5-17(13-15)28(26,27)24-10-7-18-16(14-24)4-2-6-19(18)23-11-8-22-9-12-23/h1-6,13,22H,7-12,14H2,(H2,21,25)