5-[3,5-bis(chloranyl)phenyl]sulfanyl-N,N,2-trimethyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 5-[3,5-bis(chloranyl)phenyl]sulfanyl-N,N,2-trimethyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide Openeye Name: 5-(3,5-dichlorophenyl)sulfanyl-4-isopropyl-N,N,2-trimethyl-1-(4-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 5-[(3,5-dichlorophenyl)thio]-N,N,2-trimethyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-3-pyrrolecarboxamide IUPAC Name: 5-(3,5-dichlorophenyl)sulfanyl-N,N,2-trimethyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide Traditional Name: 5-[(3,5-dichlorophenyl)thio]-4-isopropyl-N,N,2-trimethyl-1-(4-pyridylmethyl)pyrrole-3-carboxamide Formula: C23H25Cl2N3OS MolecularWeight: 462.4351

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25Cl2N3OS/c1-14(2)20-21(22(29)27(4)5)15(3)28(13-16-6-8-26-9-7-16)23(20)30-19-11-17(24)10-18(25)12-19/h6-12,14H,13H2,1-5H3