S-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate

Systemtic Name: S-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-[[[3-(1,3-benzoxazol-2-yl)anilino]-oxomethyl]amino] ester IUPAC Name: S-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamoylamino] ester Formula: C24H21N3O6S MolecularWeight: 479.50504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)SNC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)SNC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C24H21N3O6S/c1-30-19-12-15(13-20(31-2)21(19)32-3)23(28)34-27-24(29)25-16-8-6-7-14(11-16)22-26-17-9-4-5-10-18(17)33-22/h4-13H,1-3H3,(H2,25,27,29)