2-(5-azanylimidazol-4-ylidene)-N-[1-(phenylmethyl)piperidin-4-yl]-3H-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(5-azanylimidazol-4-ylidene)-N-[1-(phenylmethyl)piperidin-4-yl]-3H-1,3-oxazole-4-carboxamide Openeye Name: 2-(5-aminoimidazol-4-ylidene)-N-(1-benzyl-4-piperidyl)-3H-oxazole-4-carboxamide CAS Name: 2-(5-amino-4-imidazolylidene)-N-[1-(phenylmethyl)-4-piperidinyl]-3H-oxazole-4-carboxamide IUPAC Name: 2-(5-aminoimidazol-4-ylidene)-N-(1-benzylpiperidin-4-yl)-3H-1,3-oxazole-4-carboxamide Traditional Name: 2-(5-aminoimidazol-4-ylidene)-N-(1-benzyl-4-piperidyl)-4-oxazoline-4-carboxamide Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=COC(=C3C(=NC=N3)N)N2)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=COC(=C3C(=NC=N3)N)N2)CC4=CC=CC=C4

InChI

InChI=1S/C19H22N6O2/c20-17-16(21-12-22-17)19-24-15(11-27-19)18(26)23-14-6-8-25(9-7-14)10-13-4-2-1-3-5-13/h1-5,11-12,14,24H,6-10H2,(H,23,26)(H2,20,21,22)