4-[[5-(4-chlorophenyl)-4-(2-ethoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[[5-(4-chlorophenyl)-4-(2-ethoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: 4-[[5-(4-chlorophenyl)-4-(2-ethoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-butanenitrile CAS Name: 4-[[5-(4-chlorophenyl)-4-(2-ethoxyethyl)-1,2,4-triazol-3-yl]thio]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutanenitrile IUPAC Name: 4-[[5-(4-chlorophenyl)-4-(2-ethoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutanenitrile Traditional Name: 4-[[5-(4-chlorophenyl)-4-(2-ethoxyethyl)-1,2,4-triazol-3-yl]thio]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-butyronitrile Formula: C23H21ClN6O2S MolecularWeight: 480.96984

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C(=NN=C1SCC(=O)C(=C2NC3=CC=CC=C3N2)C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOCCN1C(=NN=C1SCC(=O)C(=C2NC3=CC=CC=C3N2)C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H21ClN6O2S/c1-2-32-12-11-30-22(15-7-9-16(24)10-8-15)28-29-23(30)33-14-20(31)17(13-25)21-26-18-5-3-4-6-19(18)27-21/h3-10,26-27H,2,11-12,14H2,1H3