1-[(4-azanylquinolin-7-yl)methyl]-4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-6-morpholin-4-ylcarbonyl-piperazin-2-one

Systemtic Name: 1-[(4-azanylquinolin-7-yl)methyl]-4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-6-morpholin-4-ylcarbonyl-piperazin-2-one Openeye Name: 1-[(4-amino-7-quinolyl)methyl]-4-(6-chlorobenzothiophen-2-yl)sulfonyl-6-(morpholine-4-carbonyl)piperazin-2-one CAS Name: 1-[(4-amino-7-quinolinyl)methyl]-4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-6-[4-morpholinyl(oxo)methyl]-2-piperazinone IUPAC Name: 1-[(4-aminoquinolin-7-yl)methyl]-4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-6-(morpholine-4-carbonyl)piperazin-2-one Traditional Name: 1-[(4-amino-7-quinolyl)methyl]-4-(6-chlorobenzothiophen-2-yl)sulfonyl-6-(morpholine-4-carbonyl)piperazin-2-one Formula: C27H26ClN5O5S2 MolecularWeight: 600.10884

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2CN(CC(=O)N2CC3=CC4=NC=CC(=C4C=C3)N)S(=O)(=O)C5=CC6=C(S5)C=C(C=C6)Cl

Isomeric SMILES

C1COCCN1C(=O)C2CN(CC(=O)N2CC3=CC4=NC=CC(=C4C=C3)N)S(=O)(=O)C5=CC6=C(S5)C=C(C=C6)Cl

InChI

InChI=1S/C27H26ClN5O5S2/c28-19-3-2-18-12-26(39-24(18)13-19)40(36,37)32-15-23(27(35)31-7-9-38-10-8-31)33(25(34)16-32)14-17-1-4-20-21(29)5-6-30-22(20)11-17/h1-6,11-13,23H,7-10,14-16H2,(H2,29,30)