6-azanyl-5-[(4-butoxyphenyl)methylideneamino]-2-oxidanylidene-1-phenyl-pyrimidine-4-carbonitrile

Systemtic Name: 6-azanyl-5-[(4-butoxyphenyl)methylideneamino]-2-oxidanylidene-1-phenyl-pyrimidine-4-carbonitrile Openeye Name: 6-amino-5-[(4-butoxyphenyl)methyleneamino]-2-oxo-1-phenyl-pyrimidine-4-carbonitrile CAS Name: 6-amino-5-[(4-butoxyphenyl)methylideneamino]-2-oxo-1-phenyl-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-5-[(4-butoxyphenyl)methylideneamino]-2-oxo-1-phenylpyrimidine-4-carbonitrile Traditional Name: 6-amino-5-[(4-butoxybenzylidene)amino]-2-keto-1-phenyl-pyrimidine-4-carbonitrile Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NC2=C(N(C(=O)N=C2C#N)C3=CC=CC=C3)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C=NC2=C(N(C(=O)N=C2C#N)C3=CC=CC=C3)N

InChI

InChI=1S/C22H21N5O2/c1-2-3-13-29-18-11-9-16(10-12-18)15-25-20-19(14-23)26-22(28)27(21(20)24)17-7-5-4-6-8-17/h4-12,15H,2-3,13,24H2,1H3