N-[[(4,6-dimethylpyrimidin-2-yl)amino]-[4-(phenylmethyl)piperidin-1-yl]methylidene]propanamide

Systemtic Name: N-[[(4,6-dimethylpyrimidin-2-yl)amino]-[4-(phenylmethyl)piperidin-1-yl]methylidene]propanamide Openeye Name: N-[(4-benzyl-1-piperidyl)-[(4,6-dimethylpyrimidin-2-yl)amino]methylene]propanamide CAS Name: N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-[4-(phenylmethyl)-1-piperidinyl]methylidene]propanamide IUPAC Name: N-[(4-benzylpiperidin-1-yl)-[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]propanamide Traditional Name: N-[(4-benzylpiperidino)-[(4,6-dimethylpyrimidin-2-yl)amino]methylene]propionamide Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N=C(NC1=NC(=CC(=N1)C)C)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N=C(NC1=NC(=CC(=N1)C)C)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N5O/c1-4-20(28)25-22(26-21-23-16(2)14-17(3)24-21)27-12-10-19(11-13-27)15-18-8-6-5-7-9-18/h5-9,14,19H,4,10-13,15H2,1-3H3,(H,23,24,25,26,28)