N-[[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)amino]-phenylazanyl-methylidene]benzamide

Systemtic Name: N-[[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)amino]-phenylazanyl-methylidene]benzamide Openeye Name: N-[anilino-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]methylene]benzamide CAS Name: N-[anilino-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]methylidene]benzamide IUPAC Name: N-[anilino-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]methylidene]benzamide Traditional Name: N-[anilino-[(4-keto-6-propyl-1H-pyrimidin-2-yl)amino]methylene]benzamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)NC(=NC(=O)C2=CC=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)NC(=NC(=O)C2=CC=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N5O2/c1-2-9-17-14-18(27)24-20(23-17)26-21(22-16-12-7-4-8-13-16)25-19(28)15-10-5-3-6-11-15/h3-8,10-14H,2,9H2,1H3,(H3,22,23,24,25,26,27,28)