2-(4-methoxyphenyl)-5-(3-piperidin-1-ylpropyl)-1,5-benzothiazepin-4-one

Systemtic Name: 2-(4-methoxyphenyl)-5-(3-piperidin-1-ylpropyl)-1,5-benzothiazepin-4-one Openeye Name: 2-(4-methoxyphenyl)-5-[3-(1-piperidyl)propyl]-1,5-benzothiazepin-4-one CAS Name: 2-(4-methoxyphenyl)-5-[3-(1-piperidinyl)propyl]-1,5-benzothiazepin-4-one IUPAC Name: 2-(4-methoxyphenyl)-5-(3-piperidin-1-ylpropyl)-1,5-benzothiazepin-4-one Traditional Name: 2-(4-methoxyphenyl)-5-(3-piperidinopropyl)-1,5-benzothiazepin-4-one Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=O)N(C3=CC=CC=C3S2)CCCN4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=O)N(C3=CC=CC=C3S2)CCCN4CCCCC4

InChI

InChI=1S/C24H28N2O2S/c1-28-20-12-10-19(11-13-20)23-18-24(27)26(21-8-3-4-9-22(21)29-23)17-7-16-25-14-5-2-6-15-25/h3-4,8-13,18H,2,5-7,14-17H2,1H3