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

Systemtic Name: 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfanyl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfanyl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methylthio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methylsulfanyl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylthio]-N-(2-thenyl)acetamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)CSCC(=O)NCC3=CC=CS3)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)CSCC(=O)NCC3=CC=CS3)N4C=CC=C4

InChI

InChI=1S/C21H20N4OS2/c26-20(22-14-19-9-6-12-28-19)16-27-15-17-13-23-25(18-7-2-1-3-8-18)21(17)24-10-4-5-11-24/h1-13H,14-16H2,(H,22,26)