4-(azepan-1-ylsulfonyl)-N-[4-phenyl-5-(phenylcarbonyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[4-phenyl-5-(phenylcarbonyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(5-benzoyl-4-phenyl-thiazol-2-yl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-(5-benzoyl-4-phenyl-2-thiazolyl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(5-benzoyl-4-phenyl-thiazol-2-yl)benzamide Formula: C29H27N3O4S2 MolecularWeight: 545.67238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=C(S3)C(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=C(S3)C(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H27N3O4S2/c33-26(22-13-7-4-8-14-22)27-25(21-11-5-3-6-12-21)30-29(37-27)31-28(34)23-15-17-24(18-16-23)38(35,36)32-19-9-1-2-10-20-32/h3-8,11-18H,1-2,9-10,19-20H2,(H,30,31,34)