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

Systemtic Name: 3-[[4-(3-cyclopropyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl)-3-methyl-phenyl]-ethyl-amino]propanenitrile Openeye Name: 3-[4-(3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl)-N-ethyl-3-methyl-anilino]propanenitrile CAS Name: 3-[4-(3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl)-N-ethyl-3-methylanilino]propanenitrile IUPAC Name: 3-[4-(3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl)-N-ethyl-3-methylanilino]propanenitrile Traditional Name: 3-[4-(3-cyclopropyl-4-keto-1,2-dihydroquinazolin-2-yl)-N-ethyl-3-methyl-anilino]propionitrile Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O/c1-3-26(14-6-13-24)18-11-12-19(16(2)15-18)22-25-21-8-5-4-7-20(21)23(28)27(22)17-9-10-17/h4-5,7-8,11-12,15,17,22,25H,3,6,9-10,14H2,1-2H3