5-(3-chloranyl-5-phenyl-phenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 5-(3-chloranyl-5-phenyl-phenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide Openeye Name: 5-(3-chloro-5-phenyl-phenyl)sulfanyl-4-isopropyl-2-methyl-1-(4-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 5-[(3-chloro-5-phenylphenyl)thio]-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-3-pyrrolecarboxamide IUPAC Name: 5-(3-chloro-5-phenylphenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxamide Traditional Name: 5-[(3-chloro-5-phenyl-phenyl)thio]-4-isopropyl-2-methyl-1-(4-pyridylmethyl)pyrrole-3-carboxamide Formula: C27H26ClN3OS MolecularWeight: 476.03284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=CC(=CC(=C3)C4=CC=CC=C4)Cl)C(C)C)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=CC(=CC(=C3)C4=CC=CC=C4)Cl)C(C)C)C(=O)N

InChI

InChI=1S/C27H26ClN3OS/c1-17(2)24-25(26(29)32)18(3)31(16-19-9-11-30-12-10-19)27(24)33-23-14-21(13-22(28)15-23)20-7-5-4-6-8-20/h4-15,17H,16H2,1-3H3,(H2,29,32)