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

Systemtic Name: 2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 2-(4-methoxyphenyl)-3-[2-(methylamino)ethyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC1C(SC2=CC=CC=C2NC1=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CNCCC1C(SC2=CC=CC=C2NC1=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H22N2O2S/c1-20-12-11-15-18(13-7-9-14(23-2)10-8-13)24-17-6-4-3-5-16(17)21-19(15)22/h3-10,15,18,20H,11-12H2,1-2H3,(H,21,22)