3-methyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: 3-methyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: 3-methyl-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: 3-methyl-N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: 3-methyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: 2-keto-3-methyl-N-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-1,3-benzoxazole-6-sulfonamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CNS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CNS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

InChI

InChI=1S/C21H21N3O4S/c1-15-6-3-4-7-16(15)14-24-11-5-8-17(24)13-22-29(26,27)18-9-10-19-20(12-18)28-21(25)23(19)2/h3-12,22H,13-14H2,1-2H3