N-[2-methyl-4-[(3,4,5-triethoxyphenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[2-methyl-4-[(3,4,5-triethoxyphenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[2-methyl-4-[(3,4,5-triethoxybenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[2-methyl-4-[[[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[2-methyl-4-[(3,4,5-triethoxybenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[2-methyl-4-[(3,4,5-triethoxybenzoyl)thiocarbamoylamino]phenyl]-2-furamide Formula: C26H29N3O6S MolecularWeight: 511.58996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)C

InChI

InChI=1S/C26H29N3O6S/c1-5-32-21-14-17(15-22(33-6-2)23(21)34-7-3)24(30)29-26(36)27-18-10-11-19(16(4)13-18)28-25(31)20-9-8-12-35-20/h8-15H,5-7H2,1-4H3,(H,28,31)(H2,27,29,30,36)