8-(4-ethylpiperazin-1-yl)carbonyl-11-methyl-6-thiophen-3-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepin-9-one

Systemtic Name: 8-(4-ethylpiperazin-1-yl)carbonyl-11-methyl-6-thiophen-3-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepin-9-one Openeye Name: 8-(4-ethylpiperazine-1-carbonyl)-11-methyl-6-(3-thienyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepin-9-one CAS Name: 8-[(4-ethyl-1-piperazinyl)-oxomethyl]-11-methyl-6-(3-thiophenyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepin-9-one IUPAC Name: 8-(4-ethylpiperazine-1-carbonyl)-11-methyl-6-thiophen-3-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepin-9-one Traditional Name: 8-(4-ethylpiperazine-1-carbonyl)-11-methyl-6-(3-thienyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepin-9-one Formula: C25H27N3O2S2 MolecularWeight: 465.63078

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=C3CC(SC4=CC=CC=C4N3C(=CC2=O)C)C5=CSC=C5

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=C3CC(SC4=CC=CC=C4N3C(=CC2=O)C)C5=CSC=C5

InChI

InChI=1S/C25H27N3O2S2/c1-3-26-9-11-27(12-10-26)25(30)24-20-15-23(18-8-13-31-16-18)32-22-7-5-4-6-19(22)28(20)17(2)14-21(24)29/h4-8,13-14,16,23H,3,9-12,15H2,1-2H3