3-[[4-(3-cyclopropyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl)phenyl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[4-(3-cyclopropyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl)phenyl]-methyl-amino]propanenitrile Openeye Name: 3-[4-(3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl)-N-methyl-anilino]propanenitrile CAS Name: 3-[4-(3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl)-N-methylanilino]propanenitrile IUPAC Name: 3-[4-(3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl)-N-methylanilino]propanenitrile Traditional Name: 3-[4-(3-cyclopropyl-4-keto-1,2-dihydroquinazolin-2-yl)-N-methyl-anilino]propionitrile Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=CC=C(C=C1)C2NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

CN(CCC#N)C1=CC=C(C=C1)C2NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C21H22N4O/c1-24(14-4-13-22)16-9-7-15(8-10-16)20-23-19-6-3-2-5-18(19)21(26)25(20)17-11-12-17/h2-3,5-10,17,20,23H,4,11-12,14H2,1H3