6-nitro-4-[2-(4-thieno[3,2-c]pyridin-4-ylpiperazin-1-yl)ethyl]-1H-quinolin-2-one hydrochloride

Systemtic Name: 6-nitro-4-[2-(4-thieno[3,2-c]pyridin-4-ylpiperazin-1-yl)ethyl]-1H-quinolin-2-one hydrochloride Openeye Name: 6-nitro-4-[2-(4-thieno[3,2-c]pyridin-4-ylpiperazin-1-yl)ethyl]-1H-quinolin-2-one hydrochloride CAS Name: 6-nitro-4-[2-[4-(4-thieno[3,2-c]pyridinyl)-1-piperazinyl]ethyl]-1H-quinolin-2-one hydrochloride IUPAC Name: 6-nitro-4-[2-(4-thieno[3,2-c]pyridin-4-ylpiperazin-1-yl)ethyl]-1H-quinolin-2-one hydrochloride Traditional Name: 6-nitro-4-[2-(4-thieno[3,2-c]pyridin-4-ylpiperazino)ethyl]carbostyril hydrochloride Formula: C22H22ClN5O3S MolecularWeight: 471.95978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC(=O)NC3=C2C=C(C=C3)[N+](=O)[O-])C4=NC=CC5=C4C=CS5.Cl

Isomeric SMILES

C1CN(CCN1CCC2=CC(=O)NC3=C2C=C(C=C3)[N+](=O)[O-])C4=NC=CC5=C4C=CS5.Cl

InChI

InChI=1S/C22H21N5O3S.ClH/c28-21-13-15(18-14-16(27(29)30)1-2-19(18)24-21)4-7-25-8-10-26(11-9-25)22-17-5-12-31-20(17)3-6-23-22;/h1-3,5-6,12-14H,4,7-11H2,(H,24,28);1H