[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[5-(1,3-benzothiazol-2-yl)furan-2-yl]methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[5-(1,3-benzothiazol-2-yl)furan-2-yl]methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[5-(1,3-benzothiazol-2-yl)-2-furyl]methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-[5-(1,3-benzothiazol-2-yl)-2-furanyl]methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[5-(1,3-benzothiazol-2-yl)furan-2-yl]methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-[5-(1,3-benzothiazol-2-yl)-2-furyl]methanone Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H26N4O4S2/c27-22(19-10-9-18(30-19)21-23-17-7-3-4-8-20(17)31-21)24-13-15-26(16-14-24)32(28,29)25-11-5-1-2-6-12-25/h3-4,7-10H,1-2,5-6,11-16H2