N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3-methyl-thiophene-2-carboxamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-3-methylthiophene-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3-methyl-thiophene-2-carboxamide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

Isomeric SMILES

CC1=C(SC=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

InChI

InChI=1S/C22H29N3O4S2/c1-17-8-15-30-21(17)22(26)23-19-16-18(31(27,28)25-11-13-29-14-12-25)6-7-20(19)24-9-4-2-3-5-10-24/h6-8,15-16H,2-5,9-14H2,1H3,(H,23,26)