5-ethyl-2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-ethyl-2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-ethyl-2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-ethyl-2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-ethyl-2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-ethyl-2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC(C(C1=O)CCNC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C2=CC=CC=C2SC(C(C1=O)CCNC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O2S/c1-4-23-18-7-5-6-8-19(18)26-20(17(21(23)24)13-14-22-2)15-9-11-16(25-3)12-10-15/h5-12,17,20,22H,4,13-14H2,1-3H3