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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C)C

InChI

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