2,9-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepine

Systemtic Name: 2,9-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepine Openeye Name: 2,9-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepine CAS Name: 2,9-dimethyl-4-(4-methyl-1-piperazinyl)thieno[2,3-b][1,5]benzoxazepine IUPAC Name: 2,9-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepine Traditional Name: 2,9-dimethyl-4-(4-methylpiperazino)thieno[2,3-b][1,5]benzoxazepine Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(C3=C(O2)SC(=C3)C)N4CCN(CC4)C

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(C3=C(O2)SC(=C3)C)N4CCN(CC4)C

InChI

InChI=1S/C18H21N3OS/c1-12-5-4-6-15-16(12)22-18-14(11-13(2)23-18)17(19-15)21-9-7-20(3)8-10-21/h4-6,11H,7-10H2,1-3H3