N-[4-[(4-propan-2-ylphenyl)carbonylcarbamothioylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(4-propan-2-ylphenyl)carbonylcarbamothioylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[(4-isopropylbenzoyl)carbamothioylamino]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[[[oxo-(4-propan-2-ylphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(4-propan-2-ylbenzoyl)carbamothioylamino]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-(cumoylthiocarbamoylamino)phenyl]thiophene-2-carboxamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O2S2/c1-14(2)15-5-7-16(8-6-15)20(26)25-22(28)24-18-11-9-17(10-12-18)23-21(27)19-4-3-13-29-19/h3-14H,1-2H3,(H,23,27)(H2,24,25,26,28)