1-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]urea

Systemtic Name: 1-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]urea Openeye Name: [(E)-[4-[bis(2-chloroethyl)amino]phenyl]methyleneamino]urea CAS Name: [(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]urea IUPAC Name: [(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]urea Traditional Name: [(E)-[4-[bis(2-chloroethyl)amino]benzylidene]amino]urea Formula: C12H16Cl2N4O MolecularWeight: 303.18764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)N)N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1/C=N/NC(=O)N)N(CCCl)CCCl

InChI

InChI=1S/C12H16Cl2N4O/c13-5-7-18(8-6-14)11-3-1-10(2-4-11)9-16-17-12(15)19/h1-4,9H,5-8H2,(H3,15,17,19)/b16-9+