6-methyl-2-(propanoylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 6-methyl-2-(propanoylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-methyl-2-(propanoylcarbamothioylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-methyl-2-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-methyl-2-(propanoylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-methyl-2-(propionylthiocarbamoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C14H19N3O2S2 MolecularWeight: 325.44956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=C(C2=C(S1)CC(CC2)C)C(=O)N

Isomeric SMILES

CCC(=O)NC(=S)NC1=C(C2=C(S1)CC(CC2)C)C(=O)N

InChI

InChI=1S/C14H19N3O2S2/c1-3-10(18)16-14(20)17-13-11(12(15)19)8-5-4-7(2)6-9(8)21-13/h7H,3-6H2,1-2H3,(H2,15,19)(H2,16,17,18,20)