1-[4-chloranyl-2-[(2-methoxyphenyl)carbamothioylamino]phenyl]-3-(2-methoxyphenyl)thiourea

Systemtic Name: 1-[4-chloranyl-2-[(2-methoxyphenyl)carbamothioylamino]phenyl]-3-(2-methoxyphenyl)thiourea Openeye Name: 1-[4-chloro-2-[(2-methoxyphenyl)carbamothioylamino]phenyl]-3-(2-methoxyphenyl)thiourea CAS Name: 1-[4-chloro-2-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]phenyl]-3-(2-methoxyphenyl)thiourea IUPAC Name: 1-[4-chloro-2-[(2-methoxyphenyl)carbamothioylamino]phenyl]-3-(2-methoxyphenyl)thiourea Traditional Name: 1-[4-chloro-2-[(2-methoxyphenyl)thiocarbamoylamino]phenyl]-3-(2-methoxyphenyl)thiourea Formula: C22H21ClN4O2S2 MolecularWeight: 473.01074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NC2=C(C=C(C=C2)Cl)NC(=S)NC3=CC=CC=C3OC

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NC2=C(C=C(C=C2)Cl)NC(=S)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H21ClN4O2S2/c1-28-19-9-5-3-7-16(19)25-21(30)24-15-12-11-14(23)13-18(15)27-22(31)26-17-8-4-6-10-20(17)29-2/h3-13H,1-2H3,(H2,24,25,30)(H2,26,27,31)