1-[bis(2-chloroethyl)amino-(diethylamino)phosphoryl]-3-(4-chlorophenyl)thiourea

Systemtic Name: 1-[bis(2-chloroethyl)amino-(diethylamino)phosphoryl]-3-(4-chlorophenyl)thiourea Openeye Name: 1-[bis(2-chloroethyl)amino-(diethylamino)phosphoryl]-3-(4-chlorophenyl)thiourea CAS Name: 1-[bis(2-chloroethyl)amino-(diethylamino)phosphoryl]-3-(4-chlorophenyl)thiourea IUPAC Name: 1-[bis(2-chloroethyl)amino-(diethylamino)phosphoryl]-3-(4-chlorophenyl)thiourea Traditional Name: 1-[bis(2-chloroethyl)amino-(diethylamino)phosphoryl]-3-(4-chlorophenyl)thiourea Formula: C15H24Cl3N4OPS MolecularWeight: 445.775021

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)P(=O)(NC(=S)NC1=CC=C(C=C1)Cl)N(CCCl)CCCl

Isomeric SMILES

CCN(CC)P(=O)(NC(=S)NC1=CC=C(C=C1)Cl)N(CCCl)CCCl

InChI

InChI=1S/C15H24Cl3N4OPS/c1-3-21(4-2)24(23,22(11-9-16)12-10-17)20-15(25)19-14-7-5-13(18)6-8-14/h5-8H,3-4,9-12H2,1-2H3,(H2,19,20,23,25)