N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]quinoxaline-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]quinoxaline-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]quinoxaline-2-carboxamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-2-quinoxalinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]quinoxaline-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]quinoxaline-2-carboxamide Formula: C25H29N5O4S MolecularWeight: 495.59386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=NC5=CC=CC=C5N=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=NC5=CC=CC=C5N=C4

InChI

InChI=1S/C25H29N5O4S/c31-25(23-18-26-20-7-3-4-8-21(20)27-23)28-22-17-19(35(32,33)30-13-15-34-16-14-30)9-10-24(22)29-11-5-1-2-6-12-29/h3-4,7-10,17-18H,1-2,5-6,11-16H2,(H,28,31)