1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(2-methyl-1,3-benzoxazol-5-yl)piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(2-methyl-1,3-benzoxazol-5-yl)piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(2-methyl-1,3-benzoxazol-5-yl)piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-(2-methyl-1,3-benzoxazol-5-yl)-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-(2-methyl-1,3-benzoxazol-5-yl)piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(2-methyl-1,3-benzoxazol-5-yl)isonipecotamide Formula: C20H23N5O5S MolecularWeight: 445.49212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

InChI

InChI=1S/C20H23N5O5S/c1-12-22-16-9-14(3-4-18(16)30-12)23-20(27)13-5-7-25(8-6-13)31(28,29)15-10-17(19(21)26)24(2)11-15/h3-4,9-11,13H,5-8H2,1-2H3,(H2,21,26)(H,23,27)