1-(4-cyanophenyl)-3-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]prop-2-enyl]urea

Systemtic Name: 1-(4-cyanophenyl)-3-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]prop-2-enyl]urea Openeye Name: 1-(4-cyanophenyl)-3-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]allyl]urea CAS Name: 1-(4-cyanophenyl)-3-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]prop-2-enyl]urea IUPAC Name: 1-(4-cyanophenyl)-3-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]prop-2-enyl]urea Traditional Name: 1-(4-cyanophenyl)-3-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]allyl]urea Formula: C21H19N5O MolecularWeight: 357.40846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CN=CN2)C=CCNC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC=C1CC2=CN=CN2)/C=C/CNC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H19N5O/c22-13-18-7-9-19(10-8-18)26-21(27)24-11-1-2-16-3-5-17(6-4-16)12-20-14-23-15-25-20/h1-10,14-15H,11-12H2,(H,23,25)(H2,24,26,27)/b2-1+