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

Systemtic Name: 1-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]prop-2-enyl]-3-(3-methoxyphenyl)urea Openeye Name: 1-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]allyl]-3-(3-methoxyphenyl)urea CAS Name: 1-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]prop-2-enyl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]prop-2-enyl]-3-(3-methoxyphenyl)urea Traditional Name: 1-[(E)-3-[4-(1H-imidazol-5-ylmethyl)phenyl]allyl]-3-(3-methoxyphenyl)urea Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NCC=CC2=CC=C(C=C2)CC3=CN=CN3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NC/C=C/C2=CC=C(C=C2)CC3=CN=CN3

InChI

InChI=1S/C21H22N4O2/c1-27-20-6-2-5-18(13-20)25-21(26)23-11-3-4-16-7-9-17(10-8-16)12-19-14-22-15-24-19/h2-10,13-15H,11-12H2,1H3,(H,22,24)(H2,23,25,26)/b4-3+