1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 2-(1-allylbenzimidazol-2-yl)sulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone CAS Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 2-[(1-allylbenzimidazol-2-yl)thio]-1-(3-phenyl-2-pyrazolin-1-yl)ethanone Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2N=C1SCC(=O)N3CCC(=N3)C4=CC=CC=C4

Isomeric SMILES

C=CCN1C2=CC=CC=C2N=C1SCC(=O)N3CCC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS/c1-2-13-24-19-11-7-6-10-18(19)22-21(24)27-15-20(26)25-14-12-17(23-25)16-8-4-3-5-9-16/h2-11H,1,12-15H2