1-[7-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one

Systemtic Name: 1-[7-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one Openeye Name: 1-[7-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one CAS Name: 1-[7-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]-2-propen-1-one IUPAC Name: 1-[7-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one Traditional Name: 1-[7-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CN(CC3=C(S2)C=CC(=C3)OC)C(=O)C=C

Isomeric SMILES

COC1=CC=C(C=C1)C2CN(CC3=C(S2)C=CC(=C3)OC)C(=O)C=C

InChI

InChI=1S/C20H21NO3S/c1-4-20(22)21-12-15-11-17(24-3)9-10-18(15)25-19(13-21)14-5-7-16(23-2)8-6-14/h4-11,19H,1,12-13H2,2-3H3