N-[4-[[2-(2-dimethylaminoethyl)-2H-1,5-benzothiazepin-5-yl]carbonyl]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[[2-(2-dimethylaminoethyl)-2H-1,5-benzothiazepin-5-yl]carbonyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[2-(2-dimethylaminoethyl)-2H-1,5-benzothiazepine-5-carbonyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[2-(2-dimethylaminoethyl)-2H-1,5-benzothiazepin-5-yl]-oxomethyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[2-(2-dimethylaminoethyl)-2H-1,5-benzothiazepine-5-carbonyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[2-(2-dimethylaminoethyl)-2H-1,5-benzothiazepine-5-carbonyl]phenyl]-2-methyl-benzamide Formula: C28H29N3O2S MolecularWeight: 471.61376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3C=CC(SC4=CC=CC=C43)CCN(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3C=CC(SC4=CC=CC=C43)CCN(C)C

InChI

InChI=1S/C28H29N3O2S/c1-20-8-4-5-9-24(20)27(32)29-22-14-12-21(13-15-22)28(33)31-19-17-23(16-18-30(2)3)34-26-11-7-6-10-25(26)31/h4-15,17,19,23H,16,18H2,1-3H3,(H,29,32)