3-(3-methylbutoxy)-N-[(thiophen-2-ylcarbonylamino)carbamothioyl]benzamide

Systemtic Name: 3-(3-methylbutoxy)-N-[(thiophen-2-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 3-isopentyloxy-N-[(thiophene-2-carbonylamino)carbamothioyl]benzamide CAS Name: 3-(3-methylbutoxy)-N-[[[oxo(thiophen-2-yl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(3-methylbutoxy)-N-[(thiophene-2-carbonylamino)carbamothioyl]benzamide Traditional Name: 3-isoamoxy-N-[(2-thenoylamino)thiocarbamoyl]benzamide Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=CS2

InChI

InChI=1S/C18H21N3O3S2/c1-12(2)8-9-24-14-6-3-5-13(11-14)16(22)19-18(25)21-20-17(23)15-7-4-10-26-15/h3-7,10-12H,8-9H2,1-2H3,(H,20,23)(H2,19,21,22,25)