N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-4-(2-thienyl)butanamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-4-(2-thienyl)butyramide Formula: C24H33N3O4S2 MolecularWeight: 491.66652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CCCC4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CCCC4=CC=CS4

InChI

InChI=1S/C24H33N3O4S2/c28-24(9-5-7-20-8-6-18-32-20)25-22-19-21(33(29,30)27-14-16-31-17-15-27)10-11-23(22)26-12-3-1-2-4-13-26/h6,8,10-11,18-19H,1-5,7,9,12-17H2,(H,25,28)