(4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-thiophen-2-yl-methanone

Systemtic Name: (4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-thiophen-2-yl-methanone Openeye Name: (4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-(2-thienyl)methanone CAS Name: [4-(6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: (4-benzo[b][1,4]benzoxazepin-6-yl-2-methylpiperazin-1-yl)-thiophen-2-ylmethanone Traditional Name: (4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazino)-(2-thienyl)methanone Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC=CS2)C3=NC4=CC=CC=C4OC5=CC=CC=C53

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC=CS2)C3=NC4=CC=CC=C4OC5=CC=CC=C53

InChI

InChI=1S/C23H21N3O2S/c1-16-15-25(12-13-26(16)23(27)21-11-6-14-29-21)22-17-7-2-4-9-19(17)28-20-10-5-3-8-18(20)24-22/h2-11,14,16H,12-13,15H2,1H3