N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[(6-morpholino-1,3-benzothiazol-2-yl)carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[[6-(4-morpholinyl)-1,3-benzothiazol-2-yl]amino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[(6-morpholino-1,3-benzothiazol-2-yl)thiocarbamoyl]thiophene-2-carboxamide Formula: C17H16N4O2S3 MolecularWeight: 404.52954

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=S)NC(=O)C4=CC=CS4

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=S)NC(=O)C4=CC=CS4

InChI

InChI=1S/C17H16N4O2S3/c22-15(13-2-1-9-25-13)19-16(24)20-17-18-12-4-3-11(10-14(12)26-17)21-5-7-23-8-6-21/h1-4,9-10H,5-8H2,(H2,18,19,20,22,24)