4-[7-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[7-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: 4-(7-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-butanenitrile CAS Name: 4-[[7-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutanenitrile IUPAC Name: 4-[7-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutanenitrile Traditional Name: 4-[(7-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-butyronitrile Formula: C23H20ClN5O2S MolecularWeight: 465.9552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N

InChI

InChI=1S/C23H20ClN5O2S/c1-13(2)11-29-22(31)15-8-7-14(24)9-19(15)28-23(29)32-12-20(30)16(10-25)21-26-17-5-3-4-6-18(17)27-21/h3-9,13,26-27H,11-12H2,1-2H3