N-(7-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-5-yl)-2-[3-(phenylsulfonyl)propanoylamino]propanamide

Systemtic Name: N-(7-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-5-yl)-2-[3-(phenylsulfonyl)propanoylamino]propanamide Openeye Name: 2-[3-(benzenesulfonyl)propanoylamino]-N-(7-methyl-6-oxo-7H-benzo[d][1]benzazepin-5-yl)propanamide CAS Name: 2-[[3-(benzenesulfonyl)-1-oxopropyl]amino]-N-(7-methyl-6-oxo-7H-benzo[d][1]benzazepin-5-yl)propanamide IUPAC Name: 2-[3-(benzenesulfonyl)propanoylamino]-N-(7-methyl-6-oxo-7H-benzo[d][1]benzazepin-5-yl)propanamide Traditional Name: 2-(3-besylpropanoylamino)-N-(6-keto-7-methyl-7H-benzo[d][1]benzazepin-5-yl)propionamide Formula: C27H27N3O5S MolecularWeight: 505.58538

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)NC(=O)C(C)NC(=O)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)NC(=O)C(C)NC(=O)CCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O5S/c1-18-21-12-6-7-13-22(21)23-14-8-9-15-24(23)30(27(18)33)29-26(32)19(2)28-25(31)16-17-36(34,35)20-10-4-3-5-11-20/h3-15,18-19H,16-17H2,1-2H3,(H,28,31)(H,29,32)