1-[(E)-[4-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)-4-phenyl-3-(piperidin-1-ylmethyl)butan-2-ylidene]amino]urea

Systemtic Name: 1-[(E)-[4-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)-4-phenyl-3-(piperidin-1-ylmethyl)butan-2-ylidene]amino]urea Openeye Name: [(E)-[3-(2-hydroxy-4-oxo-chromen-3-yl)-1-methyl-3-phenyl-2-(1-piperidylmethyl)propylidene]amino]urea CAS Name: [(E)-[4-(2-hydroxy-4-oxo-1-benzopyran-3-yl)-4-phenyl-3-(1-piperidinylmethyl)butan-2-ylidene]amino]urea IUPAC Name: [(E)-[4-(2-hydroxy-4-oxochromen-3-yl)-4-phenyl-3-(piperidin-1-ylmethyl)butan-2-ylidene]amino]urea Traditional Name: [(E)-[3-(2-hydroxy-4-keto-chromen-3-yl)-1-methyl-3-phenyl-2-(piperidinomethyl)propylidene]amino]urea Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)N)C(CN1CCCCC1)C(C2=CC=CC=C2)C3=C(OC4=CC=CC=C4C3=O)O

Isomeric SMILES

C/C(=N\NC(=O)N)/C(CN1CCCCC1)C(C2=CC=CC=C2)C3=C(OC4=CC=CC=C4C3=O)O

InChI

InChI=1S/C26H30N4O4/c1-17(28-29-26(27)33)20(16-30-14-8-3-9-15-30)22(18-10-4-2-5-11-18)23-24(31)19-12-6-7-13-21(19)34-25(23)32/h2,4-7,10-13,20,22,32H,3,8-9,14-16H2,1H3,(H3,27,29,33)/b28-17+