3-methyl-6-(4-methylpiperazin-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine

Systemtic Name: 3-methyl-6-(4-methylpiperazin-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine Openeye Name: 3-methyl-6-(4-methylpiperazin-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine CAS Name: 3-methyl-6-(4-methyl-1-piperazinyl)pyrrolo[2,1-b][1,3]benzothiazepine IUPAC Name: 3-methyl-6-(4-methylpiperazin-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine Traditional Name: 3-methyl-6-(4-methylpiperazino)pyrrolo[2,1-b][1,3]benzothiazepine Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C2N1C=C(C3=CC=CC=C3S2)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=C2N1C=C(C3=CC=CC=C3S2)N4CCN(CC4)C

InChI

InChI=1S/C18H21N3S/c1-14-7-8-18-21(14)13-16(20-11-9-19(2)10-12-20)15-5-3-4-6-17(15)22-18/h3-8,13H,9-12H2,1-2H3