N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-4-(2-sulfanylidene-1H-imidazol-3-yl)benzamide

Systemtic Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-4-(2-sulfanylidene-1H-imidazol-3-yl)benzamide Openeye Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-4-(2-thioxo-1H-imidazol-3-yl)benzamide CAS Name: N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]-4-(2-sulfanylidene-1H-imidazol-3-yl)benzamide IUPAC Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-4-(2-sulfanylidene-1H-imidazol-3-yl)benzamide Traditional Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-4-(2-thioxo-4-imidazolin-1-yl)benzamide Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)N4C=CNC4=S

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)N4C=CNC4=S

InChI

InChI=1S/C21H19N5OS/c1-24(14-16-13-23-26(15-16)19-5-3-2-4-6-19)20(27)17-7-9-18(10-8-17)25-12-11-22-21(25)28/h2-13,15H,14H2,1H3,(H,22,28)