[5-(2-dimethylaminoethyl)-8-methyl-2-(4-methylphenyl)-4-oxidanylidene-3,5-dihydro-2H-1-benzothiepin-3-yl] ethanoate

Systemtic Name: [5-(2-dimethylaminoethyl)-8-methyl-2-(4-methylphenyl)-4-oxidanylidene-3,5-dihydro-2H-1-benzothiepin-3-yl] ethanoate Openeye Name: [5-(2-dimethylaminoethyl)-8-methyl-4-oxo-2-(p-tolyl)-3,5-dihydro-2H-1-benzothiepin-3-yl] acetate CAS Name: acetic acid [5-(2-dimethylaminoethyl)-8-methyl-2-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1-benzothiepin-3-yl] ester IUPAC Name: [5-(2-dimethylaminoethyl)-8-methyl-2-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1-benzothiepin-3-yl] acetate Traditional Name: acetic acid [5-(2-dimethylaminoethyl)-4-keto-8-methyl-2-(p-tolyl)-3,5-dihydro-2H-1-benzothiepin-3-yl] ester Formula: C24H29NO3S MolecularWeight: 411.55696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=O)C(C3=C(S2)C=C(C=C3)C)CCN(C)C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(=O)C(C3=C(S2)C=C(C=C3)C)CCN(C)C)OC(=O)C

InChI

InChI=1S/C24H29NO3S/c1-15-6-9-18(10-7-15)24-23(28-17(3)26)22(27)20(12-13-25(4)5)19-11-8-16(2)14-21(19)29-24/h6-11,14,20,23-24H,12-13H2,1-5H3