[4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-(2,8-dimethyl-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)piperazino]-(2-thienyl)methanone Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=CC(=C3)C)N=C2N4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=CC(=C3)C)N=C2N4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C24H23N3O2S/c1-16-6-8-20-18(14-16)23(25-19-7-5-17(2)15-21(19)29-20)26-9-11-27(12-10-26)24(28)22-4-3-13-30-22/h3-8,13-15H,9-12H2,1-2H3