2-ethanimidoyl-4-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-ethanimidoyl-4-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]butyronitrile Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCOC

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCOC

InChI

InChI=1S/C18H20N4O3S/c1-12(20)14(10-19)16(23)11-26-18-21-15-7-4-3-6-13(15)17(24)22(18)8-5-9-25-2/h3-4,6-7,14,20H,5,8-9,11H2,1-2H3