4-(azepan-1-ylsulfonyl)-N-(3,4-dimethylphenyl)-N,3,5-trimethyl-1H-pyrrole-2-carboxamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(3,4-dimethylphenyl)-N,3,5-trimethyl-1H-pyrrole-2-carboxamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(3,4-dimethylphenyl)-N,3,5-trimethyl-1H-pyrrole-2-carboxamide CAS Name: 4-(1-azepanylsulfonyl)-N-(3,4-dimethylphenyl)-N,3,5-trimethyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(3,4-dimethylphenyl)-N,3,5-trimethyl-1H-pyrrole-2-carboxamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(3,4-dimethylphenyl)-N,3,5-trimethyl-1H-pyrrole-2-carboxamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C)C(=O)C2=C(C(=C(N2)C)S(=O)(=O)N3CCCCCC3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C)C(=O)C2=C(C(=C(N2)C)S(=O)(=O)N3CCCCCC3)C)C

InChI

InChI=1S/C22H31N3O3S/c1-15-10-11-19(14-16(15)2)24(5)22(26)20-17(3)21(18(4)23-20)29(27,28)25-12-8-6-7-9-13-25/h10-11,14,23H,6-9,12-13H2,1-5H3