N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4,6-trimethyl-benzamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4,6-trimethyl-benzamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4,6-trimethyl-benzamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4,6-trimethylbenzamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4,6-trimethylbenzamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4,6-trimethyl-benzamide Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C25H26N2O3S/c1-17-14-18(2)24(19(3)15-17)25(28)26-22-8-10-23(11-9-22)31(29,30)27-13-12-20-6-4-5-7-21(20)16-27/h4-11,14-15H,12-13,16H2,1-3H3,(H,26,28)