(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl N'-(2-methoxyphenyl)carbamimidothioate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl N'-(2-methoxyphenyl)carbamimidothioate Openeye Name: 2-[(7-methoxy-2-oxo-chromen-4-yl)methyl]-3-(2-methoxyphenyl)isothiourea CAS Name: N'-(2-methoxyphenyl)carbamimidothioic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl N'-(2-methoxyphenyl)carbamimidothioate Traditional Name: 2-[(2-keto-7-methoxy-chromen-4-yl)methyl]-3-(2-methoxyphenyl)isothiourea Formula: C19H18N2O4S MolecularWeight: 370.42222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC(=NC3=CC=CC=C3OC)N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC(=NC3=CC=CC=C3OC)N

InChI

InChI=1S/C19H18N2O4S/c1-23-13-7-8-14-12(9-18(22)25-17(14)10-13)11-26-19(20)21-15-5-3-4-6-16(15)24-2/h3-10H,11H2,1-2H3,(H2,20,21)