1-[bis(2-chloroethyl)amino-phenoxy-phosphoryl]-3-(1-diphenoxyphosphorylethyl)thiourea

Systemtic Name: 1-[bis(2-chloroethyl)amino-phenoxy-phosphoryl]-3-(1-diphenoxyphosphorylethyl)thiourea Openeye Name: 1-[bis(2-chloroethyl)amino-phenoxy-phosphoryl]-3-(1-diphenoxyphosphorylethyl)thiourea CAS Name: 1-[bis(2-chloroethyl)amino-phenoxyphosphoryl]-3-(1-diphenoxyphosphorylethyl)thiourea IUPAC Name: 1-[bis(2-chloroethyl)amino-phenoxyphosphoryl]-3-(1-diphenoxyphosphorylethyl)thiourea Traditional Name: 1-[bis(2-chloroethyl)amino-phenoxy-phosphoryl]-3-(1-diphenoxyphosphorylethyl)thiourea Formula: C25H29Cl2N3O5P2S MolecularWeight: 616.433382

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=S)NP(=O)(N(CCCl)CCCl)OC1=CC=CC=C1)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(NC(=S)NP(=O)(N(CCCl)CCCl)OC1=CC=CC=C1)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H29Cl2N3O5P2S/c1-21(36(31,33-22-11-5-2-6-12-22)34-23-13-7-3-8-14-23)28-25(38)29-37(32,30(19-17-26)20-18-27)35-24-15-9-4-10-16-24/h2-16,21H,17-20H2,1H3,(H2,28,29,32,38)