2-[(4-chlorophenyl)methylsulfonylmethyl]-3-oxidanylidene-N-(3-piperidin-1-ylpropyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(4-chlorophenyl)methylsulfonylmethyl]-3-oxidanylidene-N-(3-piperidin-1-ylpropyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(4-chlorophenyl)methylsulfonylmethyl]-3-oxo-N-[3-(1-piperidyl)propyl]-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[(4-chlorophenyl)methylsulfonylmethyl]-3-oxo-N-[3-(1-piperidinyl)propyl]-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(4-chlorophenyl)methylsulfonylmethyl]-3-oxo-N-(3-piperidin-1-ylpropyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[(4-chlorobenzyl)sulfonylmethyl]-3-keto-N-(3-piperidinopropyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C25H31ClN4O4S MolecularWeight: 519.05604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CS(=O)(=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CS(=O)(=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H31ClN4O4S/c26-20-8-5-18(6-9-20)16-35(33,34)17-23-25(32)29-22-15-19(7-10-21(22)28-23)24(31)27-11-4-14-30-12-2-1-3-13-30/h5-10,15,23,28H,1-4,11-14,16-17H2,(H,27,31)(H,29,32)