1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(4-phenylmethoxyphenyl)thiourea

Systemtic Name: 1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(4-phenylmethoxyphenyl)thiourea Openeye Name: 1-(4-benzyloxyphenyl)-3-[4-[bis(2-chloroethyl)amino]phenyl]thiourea CAS Name: 1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(4-phenylmethoxyphenyl)thiourea IUPAC Name: 1-[4-[bis(2-chloroethyl)amino]phenyl]-3-(4-phenylmethoxyphenyl)thiourea Traditional Name: 1-(4-benzoxyphenyl)-3-[4-[bis(2-chloroethyl)amino]phenyl]thiourea Formula: C24H25Cl2N3OS MolecularWeight: 474.4458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)N(CCCl)CCCl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)N(CCCl)CCCl

InChI

InChI=1S/C24H25Cl2N3OS/c25-14-16-29(17-15-26)22-10-6-20(7-11-22)27-24(31)28-21-8-12-23(13-9-21)30-18-19-4-2-1-3-5-19/h1-13H,14-18H2,(H2,27,28,31)