[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-imidazo[1,2-a]pyridin-2-yl-methanone

Systemtic Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-imidazo[1,2-a]pyridin-2-yl-methanone Openeye Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-imidazo[1,2-a]pyridin-2-yl-methanone CAS Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-1-piperazinyl]-(2-imidazo[1,2-a]pyridinyl)methanone IUPAC Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-imidazo[1,2-a]pyridin-2-ylmethanone Traditional Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazino]-imidazo[1,2-a]pyridin-2-yl-methanone Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CN5C=CC=CC5=N4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CN5C=CC=CC5=N4)OC1

InChI

InChI=1S/C21H22N4O5S/c26-21(17-15-24-7-2-1-4-20(24)22-17)23-8-10-25(11-9-23)31(27,28)16-5-6-18-19(14-16)30-13-3-12-29-18/h1-2,4-7,14-15H,3,8-13H2