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

Systemtic Name: 2-bromanyl-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepine Openeye Name: 2-bromo-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepine CAS Name: 2-bromo-4-(4-methyl-1-piperazinyl)thieno[2,3-b][1,5]benzoxazepine IUPAC Name: 2-bromo-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepine Traditional Name: 2-bromo-4-(4-methylpiperazino)thieno[2,3-b][1,5]benzoxazepine Formula: C16H16BrN3OS MolecularWeight: 378.28674

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(S4)Br

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(S4)Br

InChI

InChI=1S/C16H16BrN3OS/c1-19-6-8-20(9-7-19)15-11-10-14(17)22-16(11)21-13-5-3-2-4-12(13)18-15/h2-5,10H,6-9H2,1H3