4,5-bis(bromanyl)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]thiophene-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]thiophene-2-carboxamide Openeye Name: 4,5-dibromo-N-[[4-(1-piperidyl)phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: 4,5-dibromo-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: 4,5-dibromo-N-[(4-piperidin-1-ylphenyl)carbamothioyl]thiophene-2-carboxamide Traditional Name: 4,5-dibromo-N-[(4-piperidinophenyl)thiocarbamoyl]thiophene-2-carboxamide Formula: C17H17Br2N3OS2 MolecularWeight: 503.27438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C17H17Br2N3OS2/c18-13-10-14(25-15(13)19)16(23)21-17(24)20-11-4-6-12(7-5-11)22-8-2-1-3-9-22/h4-7,10H,1-3,8-9H2,(H2,20,21,23,24)