[4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]piperazino]-(2-thienyl)methanone Formula: C19H21ClN2O3S MolecularWeight: 392.89964

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CN3CCN(CC3)C(=O)C4=CC=CS4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CN3CCN(CC3)C(=O)C4=CC=CS4)Cl)OC1

InChI

InChI=1S/C19H21ClN2O3S/c20-15-11-14(12-16-18(15)25-9-2-8-24-16)13-21-4-6-22(7-5-21)19(23)17-3-1-10-26-17/h1,3,10-12H,2,4-9,13H2