1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(2-methylphenyl)urea

Systemtic Name: 1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(2-methylphenyl)urea Openeye Name: 1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(o-tolyl)urea CAS Name: 1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(2-methylphenyl)urea IUPAC Name: 1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(2-methylphenyl)urea Traditional Name: 1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(o-tolyl)urea Formula: C18H21Cl2N3O MolecularWeight: 366.28484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)N(CCCl)CCCl

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)N(CCCl)CCCl

InChI

InChI=1S/C18H21Cl2N3O/c1-14-4-2-3-5-17(14)22-18(24)21-15-6-8-16(9-7-15)23(12-10-19)13-11-20/h2-9H,10-13H2,1H3,(H2,21,22,24)