4-tert-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide CAS Name: 4-tert-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide Traditional Name: 4-tert-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCCS(=O)(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCCS(=O)(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C23H30N2O3S/c1-23(2,3)21-11-9-19(10-12-21)22(26)24-14-6-16-29(27,28)25-15-13-18-7-4-5-8-20(18)17-25/h4-5,7-12H,6,13-17H2,1-3H3,(H,24,26)