4-[4-(4-phenylpiperidin-1-yl)butyl]-1,4-benzothiazepine-3,5-dione

Systemtic Name: 4-[4-(4-phenylpiperidin-1-yl)butyl]-1,4-benzothiazepine-3,5-dione Openeye Name: 4-[4-(4-phenyl-1-piperidyl)butyl]-1,4-benzothiazepine-3,5-dione CAS Name: 4-[4-(4-phenyl-1-piperidinyl)butyl]-1,4-benzothiazepine-3,5-dione IUPAC Name: 4-[4-(4-phenylpiperidin-1-yl)butyl]-1,4-benzothiazepine-3,5-dione Traditional Name: 4-[4-(4-phenylpiperidino)butyl]-1,4-benzothiazepine-3,5-quinone Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2)CCCCN3C(=O)CSC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2)CCCCN3C(=O)CSC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H28N2O2S/c27-23-18-29-22-11-5-4-10-21(22)24(28)26(23)15-7-6-14-25-16-12-20(13-17-25)19-8-2-1-3-9-19/h1-5,8-11,20H,6-7,12-18H2