N-(2,5-dimethylphenyl)-4-piperidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-piperidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-4-(1-piperidylsulfonyl)-1H-pyrrole-2-carboxamide CAS Name: N-(2,5-dimethylphenyl)-4-(1-piperidinylsulfonyl)-1H-pyrrole-2-carboxamide IUPAC Name: N-(2,5-dimethylphenyl)-4-piperidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-4-piperidinosulfonyl-1H-pyrrole-2-carboxamide Formula: C18H23N3O3S MolecularWeight: 361.45852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=CC(=CN2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=CC(=CN2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H23N3O3S/c1-13-6-7-14(2)16(10-13)20-18(22)17-11-15(12-19-17)25(23,24)21-8-4-3-5-9-21/h6-7,10-12,19H,3-5,8-9H2,1-2H3,(H,20,22)