2-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C19H20ClN3O2S2 MolecularWeight: 421.964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl)C(=O)N

InChI

InChI=1S/C19H20ClN3O2S2/c20-13-7-3-1-5-11(13)9-10-15(24)22-19(26)23-18-16(17(21)25)12-6-2-4-8-14(12)27-18/h1,3,5,7H,2,4,6,8-10H2,(H2,21,25)(H2,22,23,24,26)