1-[(3E)-2-oxidanylidene-3-[1-(1H-pyrrol-2-yl)propylidene]-1H-indol-5-yl]urea

Systemtic Name: 1-[(3E)-2-oxidanylidene-3-[1-(1H-pyrrol-2-yl)propylidene]-1H-indol-5-yl]urea Openeye Name: [(3E)-2-oxo-3-[1-(1H-pyrrol-2-yl)propylidene]indolin-5-yl]urea CAS Name: [(3E)-2-oxo-3-[1-(1H-pyrrol-2-yl)propylidene]-1H-indol-5-yl]urea IUPAC Name: [(3E)-2-oxo-3-[1-(1H-pyrrol-2-yl)propylidene]-1H-indol-5-yl]urea Traditional Name: [(3E)-2-keto-3-[1-(1H-pyrrol-2-yl)propylidene]indolin-5-yl]urea Formula: C16H16N4O2 MolecularWeight: 296.32384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C2=C(C=CC(=C2)NC(=O)N)NC1=O)C3=CC=CN3

Isomeric SMILES

CC/C(=C\1/C2=C(C=CC(=C2)NC(=O)N)NC1=O)/C3=CC=CN3

InChI

InChI=1S/C16H16N4O2/c1-2-10(12-4-3-7-18-12)14-11-8-9(19-16(17)22)5-6-13(11)20-15(14)21/h3-8,18H,2H2,1H3,(H,20,21)(H3,17,19,22)/b14-10+