3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-[4-methyl-5-(1-methyl-2-imidazolyl)-2-thiazolyl]propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]propionamide Formula: C23H29N5O3S2 MolecularWeight: 487.63806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C4=NC=CN4C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C4=NC=CN4C

InChI

InChI=1S/C23H29N5O3S2/c1-17-21(22-24-13-16-27(22)2)32-23(25-17)26-20(29)12-9-18-7-10-19(11-8-18)33(30,31)28-14-5-3-4-6-15-28/h7-8,10-11,13,16H,3-6,9,12,14-15H2,1-2H3,(H,25,26,29)