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

Systemtic Name: 4-(4-methylpiperazin-1-yl)-2-phenyl-thieno[2,3-b][1,5]benzoxazepine Openeye Name: 4-(4-methylpiperazin-1-yl)-2-phenyl-thieno[2,3-b][1,5]benzoxazepine CAS Name: 4-(4-methyl-1-piperazinyl)-2-phenylthieno[2,3-b][1,5]benzoxazepine IUPAC Name: 4-(4-methylpiperazin-1-yl)-2-phenylthieno[2,3-b][1,5]benzoxazepine Traditional Name: 4-(4-methylpiperazino)-2-phenyl-thieno[2,3-b][1,5]benzoxazepine Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(S4)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(S4)C5=CC=CC=C5

InChI

InChI=1S/C22H21N3OS/c1-24-11-13-25(14-12-24)21-17-15-20(16-7-3-2-4-8-16)27-22(17)26-19-10-6-5-9-18(19)23-21/h2-10,15H,11-14H2,1H3