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

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-5-chloranyl-thiophene-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-5-chloro-thiophene-2-carboxamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-5-chloro-2-thiophenecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-5-chlorothiophene-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-5-chloro-thiophene-2-carboxamide Formula: C21H26ClN3O4S2 MolecularWeight: 484.03184

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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=C(S4)Cl

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H26ClN3O4S2/c22-20-8-7-19(30-20)21(26)23-17-15-16(31(27,28)25-11-13-29-14-12-25)5-6-18(17)24-9-3-1-2-4-10-24/h5-8,15H,1-4,9-14H2,(H,23,26)