1-[2-[1-(3-bromophenyl)ethylamino]phenyl]-3-(4-carbamimidoylphenyl)urea

Systemtic Name: 1-[2-[1-(3-bromophenyl)ethylamino]phenyl]-3-(4-carbamimidoylphenyl)urea Openeye Name: 1-[2-[1-(3-bromophenyl)ethylamino]phenyl]-3-(4-carbamimidoylphenyl)urea CAS Name: 1-[2-[1-(3-bromophenyl)ethylamino]phenyl]-3-(4-carbamimidoylphenyl)urea IUPAC Name: 1-[2-[1-(3-bromophenyl)ethylamino]phenyl]-3-(4-carbamimidoylphenyl)urea Traditional Name: 1-(4-amidinophenyl)-3-[2-[1-(3-bromophenyl)ethylamino]phenyl]urea Formula: C22H22BrN5O MolecularWeight: 452.34698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC2=CC=CC=C2NC(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC2=CC=CC=C2NC(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H22BrN5O/c1-14(16-5-4-6-17(23)13-16)26-19-7-2-3-8-20(19)28-22(29)27-18-11-9-15(10-12-18)21(24)25/h2-14,26H,1H3,(H3,24,25)(H2,27,28,29)