N-[4-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]-2-methoxy-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]-2-methoxy-phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[(2,6-dimethoxybenzoyl)carbamothioylamino]-2-methoxy-phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[[[(2,6-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-methoxyphenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(2,6-dimethoxybenzoyl)carbamothioylamino]-2-methoxyphenyl]thiophene-2-carboxamide Traditional Name: N-[4-[(2,6-dimethoxybenzoyl)thiocarbamoylamino]-2-methoxy-phenyl]thiophene-2-carboxamide Formula: C22H21N3O5S2 MolecularWeight: 471.54924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CS3)OC

InChI

InChI=1S/C22H21N3O5S2/c1-28-15-6-4-7-16(29-2)19(15)21(27)25-22(31)23-13-9-10-14(17(12-13)30-3)24-20(26)18-8-5-11-32-18/h4-12H,1-3H3,(H,24,26)(H2,23,25,27,31)