2-[[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[4-[4-(azepan-1-ylsulfonyl)phenyl]thiazol-2-yl]methyl-methyl-amino]-N-isopropyl-acetamide CAS Name: 2-[[4-[4-(1-azepanylsulfonyl)phenyl]-2-thiazolyl]methyl-methylamino]-N-propan-2-ylacetamide IUPAC Name: 2-[[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]methyl-methylamino]-N-propan-2-ylacetamide Traditional Name: 2-[[4-[4-(azepan-1-ylsulfonyl)phenyl]thiazol-2-yl]methyl-methyl-amino]-N-isopropyl-acetamide Formula: C22H32N4O3S2 MolecularWeight: 464.64448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN(C)CC1=NC(=CS1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C)NC(=O)CN(C)CC1=NC(=CS1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H32N4O3S2/c1-17(2)23-21(27)14-25(3)15-22-24-20(16-30-22)18-8-10-19(11-9-18)31(28,29)26-12-6-4-5-7-13-26/h8-11,16-17H,4-7,12-15H2,1-3H3,(H,23,27)