N-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamothioyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-sulfanylidenemethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiocarbamoyl]-3-chloro-benzothiophene-2-carboxamide Formula: C19H16ClN3O2S3 MolecularWeight: 449.99724

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C(=O)N

InChI

InChI=1S/C19H16ClN3O2S3/c20-14-10-6-2-4-8-12(10)27-15(14)17(25)22-19(26)23-18-13(16(21)24)9-5-1-3-7-11(9)28-18/h2,4,6,8H,1,3,5,7H2,(H2,21,24)(H2,22,23,25,26)