5-[5-(azepan-1-ylcarbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-sulfonamide

Systemtic Name: 5-[5-(azepan-1-ylcarbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-sulfonamide Openeye Name: 5-[5-(azepane-1-carbonyl)-4-methyl-thiazol-2-yl]-1,2-dimethyl-N-(5-methylisoxazol-3-yl)pyrrole-3-sulfonamide CAS Name: 5-[5-[1-azepanyl(oxo)methyl]-4-methyl-2-thiazolyl]-1,2-dimethyl-N-(5-methyl-3-isoxazolyl)-3-pyrrolesulfonamide IUPAC Name: 5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-sulfonamide Traditional Name: 5-[5-(azepane-1-carbonyl)-4-methyl-thiazol-2-yl]-1,2-dimethyl-N-(5-methylisoxazol-3-yl)pyrrole-3-sulfonamide Formula: C21H27N5O4S2 MolecularWeight: 477.60018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=C(N(C(=C2)C3=NC(=C(S3)C(=O)N4CCCCCC4)C)C)C

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=C(N(C(=C2)C3=NC(=C(S3)C(=O)N4CCCCCC4)C)C)C

InChI

InChI=1S/C21H27N5O4S2/c1-13-11-18(23-30-13)24-32(28,29)17-12-16(25(4)15(17)3)20-22-14(2)19(31-20)21(27)26-9-7-5-6-8-10-26/h11-12H,5-10H2,1-4H3,(H,23,24)