2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfanyl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfanyl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfanyl]acetamide CAS Name: 2-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methylthio]-N-propan-2-ylacetamide IUPAC Name: 2-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methylsulfanyl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylthio]acetamide Formula: C19H22N4OS MolecularWeight: 354.46918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSCC1=C(N(N=C1)C2=CC=CC=C2)N3C=CC=C3

Isomeric SMILES

CC(C)NC(=O)CSCC1=C(N(N=C1)C2=CC=CC=C2)N3C=CC=C3

InChI

InChI=1S/C19H22N4OS/c1-15(2)21-18(24)14-25-13-16-12-20-23(17-8-4-3-5-9-17)19(16)22-10-6-7-11-22/h3-12,15H,13-14H2,1-2H3,(H,21,24)