3-[(4-methylpiperazin-1-yl)methyl]-2-phenyl-2,3-dihydro-1,5-benzothiazepine

Systemtic Name: 3-[(4-methylpiperazin-1-yl)methyl]-2-phenyl-2,3-dihydro-1,5-benzothiazepine Openeye Name: 3-[(4-methylpiperazin-1-yl)methyl]-2-phenyl-2,3-dihydro-1,5-benzothiazepine CAS Name: 3-[(4-methyl-1-piperazinyl)methyl]-2-phenyl-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 3-[(4-methylpiperazin-1-yl)methyl]-2-phenyl-2,3-dihydro-1,5-benzothiazepine Traditional Name: 3-[(4-methylpiperazino)methyl]-2-phenyl-2,3-dihydro-1,5-benzothiazepine Formula: C21H25N3S MolecularWeight: 351.5083

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2C=NC3=CC=CC=C3SC2C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)CC2C=NC3=CC=CC=C3SC2C4=CC=CC=C4

InChI

InChI=1S/C21H25N3S/c1-23-11-13-24(14-12-23)16-18-15-22-19-9-5-6-10-20(19)25-21(18)17-7-3-2-4-8-17/h2-10,15,18,21H,11-14,16H2,1H3