3-(butylamino)-N-(butylcarbamothioyl)-6,7-dimethyl-quinoxaline-2-carboxamide

Systemtic Name: 3-(butylamino)-N-(butylcarbamothioyl)-6,7-dimethyl-quinoxaline-2-carboxamide Openeye Name: 3-(butylamino)-N-(butylcarbamothioyl)-6,7-dimethyl-quinoxaline-2-carboxamide CAS Name: 3-(butylamino)-N-[butylamino(sulfanylidene)methyl]-6,7-dimethyl-2-quinoxalinecarboxamide IUPAC Name: 3-(butylamino)-N-(butylcarbamothioyl)-6,7-dimethylquinoxaline-2-carboxamide Traditional Name: 3-(butylamino)-N-(butylthiocarbamoyl)-6,7-dimethyl-quinoxaline-2-carboxamide Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C=C(C(=C2)C)C)N=C1C(=O)NC(=S)NCCCC

Isomeric SMILES

CCCCNC1=NC2=C(C=C(C(=C2)C)C)N=C1C(=O)NC(=S)NCCCC

InChI

InChI=1S/C20H29N5OS/c1-5-7-9-21-18-17(19(26)25-20(27)22-10-8-6-2)23-15-11-13(3)14(4)12-16(15)24-18/h11-12H,5-10H2,1-4H3,(H,21,24)(H2,22,25,26,27)