3-(3-bromophenyl)-1-(1-phenylethyl)-1-[(2E)-2-(phenylmethylidene)heptyl]urea

Systemtic Name: 3-(3-bromophenyl)-1-(1-phenylethyl)-1-[(2E)-2-(phenylmethylidene)heptyl]urea Openeye Name: 1-[(2E)-2-benzylideneheptyl]-3-(3-bromophenyl)-1-(1-phenylethyl)urea CAS Name: 3-(3-bromophenyl)-1-(1-phenylethyl)-1-[(2E)-2-(phenylmethylene)heptyl]urea IUPAC Name: 1-[(2E)-2-benzylideneheptyl]-3-(3-bromophenyl)-1-(1-phenylethyl)urea Traditional Name: 1-[(E)-2-amyl-3-phenyl-allyl]-3-(3-bromophenyl)-1-(1-phenylethyl)urea Formula: C29H33BrN2O MolecularWeight: 505.48912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC1=CC=CC=C1)CN(C(C)C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CCCCC/C(=C\C1=CC=CC=C1)/CN(C(C)C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C29H33BrN2O/c1-3-4-7-15-25(20-24-13-8-5-9-14-24)22-32(23(2)26-16-10-6-11-17-26)29(33)31-28-19-12-18-27(30)21-28/h5-6,8-14,16-21,23H,3-4,7,15,22H2,1-2H3,(H,31,33)/b25-20+