1-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[2-(3,4-dihydroxyphenyl)ethyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[2-(3,4-dihydroxyphenyl)ethyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[2-(3,4-dihydroxyphenyl)ethyl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[2-(3,4-dihydroxyphenyl)ethyl]-3-(3-methoxyphenyl)thiourea Formula: C16H18N2O3S MolecularWeight: 318.39072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NCCC2=CC(=C(C=C2)O)O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NCCC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C16H18N2O3S/c1-21-13-4-2-3-12(10-13)18-16(22)17-8-7-11-5-6-14(19)15(20)9-11/h2-6,9-10,19-20H,7-8H2,1H3,(H2,17,18,22)