2-(2,3,5,6-tetramethylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(2,3,5,6-tetramethylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(2,3,5,6-tetramethylphenyl)sulfonyl-N-(2-thienylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(2,3,5,6-tetramethylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(2,3,5,6-tetramethylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2,3,5,6-tetramethylphenyl)sulfonyl-N-(2-thenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCC4=CC=CS4)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCC4=CC=CS4)C)C

InChI

InChI=1S/C25H28N2O3S2/c1-16-12-17(2)19(4)24(18(16)3)32(29,30)27-15-21-9-6-5-8-20(21)13-23(27)25(28)26-14-22-10-7-11-31-22/h5-12,23H,13-15H2,1-4H3,(H,26,28)