1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-pyrrolidin-1-ylsulfonyl-quinolin-2-one

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-pyrrolidin-1-ylsulfonyl-quinolin-2-one Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-6-pyrrolidin-1-ylsulfonyl-quinolin-2-one CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]-6-(1-pyrrolidinylsulfonyl)-2-quinolinone IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]-6-pyrrolidin-1-ylsulfonylquinolin-2-one Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]-6-pyrrolidinosulfonyl-carbostyril Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H27N3O4S/c25-20-10-7-17-15-18(29(27,28)23-13-5-6-14-23)8-9-19(17)24(20)16-21(26)22-11-3-1-2-4-12-22/h7-10,15H,1-6,11-14,16H2