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

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]thiophene-2-carboxamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]thiophene-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]thiophene-2-carboxamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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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=CC=CS4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H27N3O4S2/c25-21(20-6-5-15-29-20)22-18-16-17(30(26,27)24-11-13-28-14-12-24)7-8-19(18)23-9-3-1-2-4-10-23/h5-8,15-16H,1-4,9-14H2,(H,22,25)