6-(4-methylpiperazin-1-yl)-8-(trifluoromethyl)benzo[b][1,4]benzothiazepine

Systemtic Name: 6-(4-methylpiperazin-1-yl)-8-(trifluoromethyl)benzo[b][1,4]benzothiazepine Openeye Name: 6-(4-methylpiperazin-1-yl)-8-(trifluoromethyl)benzo[b][1,4]benzothiazepine CAS Name: 6-(4-methyl-1-piperazinyl)-8-(trifluoromethyl)benzo[b][1,4]benzothiazepine IUPAC Name: 6-(4-methylpiperazin-1-yl)-8-(trifluoromethyl)benzo[b][1,4]benzothiazepine Traditional Name: 6-(4-methylpiperazino)-8-(trifluoromethyl)benzo[b][1,4]benzothiazepine Formula: C19H18F3N3S MolecularWeight: 377.42653

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C19H18F3N3S/c1-24-8-10-25(11-9-24)18-14-12-13(19(20,21)22)6-7-16(14)26-17-5-3-2-4-15(17)23-18/h2-7,12H,8-11H2,1H3