5-[3,5-bis(chloranyl)phenyl]sulfanyl-4-cyclopropyl-2-methyl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 5-[3,5-bis(chloranyl)phenyl]sulfanyl-4-cyclopropyl-2-methyl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide Openeye Name: 4-cyclopropyl-5-(3,5-dichlorophenyl)sulfanyl-2-methyl-1-(4-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 4-cyclopropyl-5-[(3,5-dichlorophenyl)thio]-2-methyl-1-(pyridin-4-ylmethyl)-3-pyrrolecarboxamide IUPAC Name: 4-cyclopropyl-5-(3,5-dichlorophenyl)sulfanyl-2-methyl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide Traditional Name: 4-cyclopropyl-5-[(3,5-dichlorophenyl)thio]-2-methyl-1-(4-pyridylmethyl)pyrrole-3-carboxamide Formula: C21H19Cl2N3OS MolecularWeight: 432.36606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=CC(=CC(=C3)Cl)Cl)C4CC4)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=CC(=CC(=C3)Cl)Cl)C4CC4)C(=O)N

InChI

InChI=1S/C21H19Cl2N3OS/c1-12-18(20(24)27)19(14-2-3-14)21(26(12)11-13-4-6-25-7-5-13)28-17-9-15(22)8-16(23)10-17/h4-10,14H,2-3,11H2,1H3,(H2,24,27)