4,5-dimethyl-2-[(4-propoxyphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-2-[(4-propoxyphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-2-[(4-propoxybenzoyl)carbamothioylamino]thiophene-3-carboxamide CAS Name: 4,5-dimethyl-2-[[[[oxo-(4-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-2-[(4-propoxybenzoyl)carbamothioylamino]thiophene-3-carboxamide Traditional Name: 4,5-dimethyl-2-[(4-propoxybenzoyl)thiocarbamoylamino]thiophene-3-carboxamide Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N

InChI

InChI=1S/C18H21N3O3S2/c1-4-9-24-13-7-5-12(6-8-13)16(23)20-18(25)21-17-14(15(19)22)10(2)11(3)26-17/h5-8H,4,9H2,1-3H3,(H2,19,22)(H2,20,21,23,25)