6-(2,5-dimethoxyphenyl)-6,12-dihydroindeno[2,1-c][1,5]benzothiazepin-7-one

Systemtic Name: 6-(2,5-dimethoxyphenyl)-6,12-dihydroindeno[2,1-c][1,5]benzothiazepin-7-one Openeye Name: 6-(2,5-dimethoxyphenyl)-6,12-dihydroindeno[2,1-c][1,5]benzothiazepin-7-one CAS Name: 6-(2,5-dimethoxyphenyl)-6,12-dihydroindeno[2,1-c][1,5]benzothiazepin-7-one IUPAC Name: 6-(2,5-dimethoxyphenyl)-6,12-dihydroindeno[2,1-c][1,5]benzothiazepin-7-one Traditional Name: 6-(2,5-dimethoxyphenyl)-6,12-dihydroindeno[2,1-c][1,5]benzothiazepin-7-one Formula: C24H19NO3S MolecularWeight: 401.47756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2C(=O)C=CC3=C2N=C4C(=CS3)CC5=CC=CC=C54

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2C(=O)C=CC3=C2N=C4C(=CS3)CC5=CC=CC=C54

InChI

InChI=1S/C24H19NO3S/c1-27-16-7-9-20(28-2)18(12-16)22-19(26)8-10-21-24(22)25-23-15(13-29-21)11-14-5-3-4-6-17(14)23/h3-10,12-13,22H,11H2,1-2H3