1-[[3,4-bis(oxidanyl)phenyl]methyl]-3-(4-chlorophenyl)thiourea

Systemtic Name: 1-[[3,4-bis(oxidanyl)phenyl]methyl]-3-(4-chlorophenyl)thiourea Openeye Name: 1-(4-chlorophenyl)-3-[(3,4-dihydroxyphenyl)methyl]thiourea CAS Name: 1-(4-chlorophenyl)-3-[(3,4-dihydroxyphenyl)methyl]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[(3,4-dihydroxyphenyl)methyl]thiourea Traditional Name: 1-(4-chlorophenyl)-3-protocatechuyl-thiourea Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NCC2=CC(=C(C=C2)O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NCC2=CC(=C(C=C2)O)O)Cl

InChI

InChI=1S/C14H13ClN2O2S/c15-10-2-4-11(5-3-10)17-14(20)16-8-9-1-6-12(18)13(19)7-9/h1-7,18-19H,8H2,(H2,16,17,20)