2-methyl-N-[4-[2-(7-methylsulfonyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide

Systemtic Name: 2-methyl-N-[4-[2-(7-methylsulfonyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide Openeye Name: 2-methyl-N-[4-[2-(7-methylsulfonyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide CAS Name: 2-methyl-N-[4-[2-(7-methylsulfonyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-5-quinolinecarboxamide IUPAC Name: 2-methyl-N-[4-[2-(7-methylsulfonyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide Traditional Name: N-[4-[2-(7-mesyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-2-methyl-quinoline-5-carboxamide Formula: C30H37N3O3S MolecularWeight: 519.69808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC(=C2C=C1)C(=O)NC3CCC(CC3)CCN4CCC5=C(CC4)C=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CC1=NC2=CC=CC(=C2C=C1)C(=O)NC3CCC(CC3)CCN4CCC5=C(CC4)C=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C30H37N3O3S/c1-21-6-13-27-28(4-3-5-29(27)31-21)30(34)32-25-10-7-22(8-11-25)14-17-33-18-15-23-9-12-26(37(2,35)36)20-24(23)16-19-33/h3-6,9,12-13,20,22,25H,7-8,10-11,14-19H2,1-2H3,(H,32,34)