9-[(4-methylpiperazin-1-yl)methyl]-6-phenyl-6H-pyrrolo[2,1-c][1,4]benzothiazepin-11-one

Systemtic Name: 9-[(4-methylpiperazin-1-yl)methyl]-6-phenyl-6H-pyrrolo[2,1-c][1,4]benzothiazepin-11-one Openeye Name: 9-[(4-methylpiperazin-1-yl)methyl]-6-phenyl-6H-pyrrolo[2,1-c][1,4]benzothiazepin-11-one CAS Name: 9-[(4-methyl-1-piperazinyl)methyl]-6-phenyl-6H-pyrrolo[2,1-c][1,4]benzothiazepin-11-one IUPAC Name: 9-[(4-methylpiperazin-1-yl)methyl]-6-phenyl-6H-pyrrolo[2,1-c][1,4]benzothiazepin-11-one Traditional Name: 9-[(4-methylpiperazino)methyl]-6-phenyl-6H-pyrrolo[2,1-c][1,4]benzothiazepin-11-one Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C3N2C(=O)C4=CC=CC=C4SC3C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C3N2C(=O)C4=CC=CC=C4SC3C5=CC=CC=C5

InChI

InChI=1S/C24H25N3OS/c1-25-13-15-26(16-14-25)17-19-11-12-21-23(18-7-3-2-4-8-18)29-22-10-6-5-9-20(22)24(28)27(19)21/h2-12,23H,13-17H2,1H3