6-(6-oxidanylideneheptan-3-ylamino)-3-thiophen-2-yl-1H-1,3,5-triazine-2,4-dione

Systemtic Name: 6-(6-oxidanylideneheptan-3-ylamino)-3-thiophen-2-yl-1H-1,3,5-triazine-2,4-dione Openeye Name: 6-[(1-ethyl-4-oxo-pentyl)amino]-3-(2-thienyl)-1H-1,3,5-triazine-2,4-dione CAS Name: 6-(6-oxoheptan-3-ylamino)-3-thiophen-2-yl-1H-1,3,5-triazine-2,4-dione IUPAC Name: 6-(6-oxoheptan-3-ylamino)-3-thiophen-2-yl-1H-1,3,5-triazine-2,4-dione Traditional Name: 6-[(1-ethyl-4-keto-pentyl)amino]-3-(2-thienyl)-1H-s-triazine-2,4-quinone Formula: C14H18N4O3S MolecularWeight: 322.38272

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)C)NC1=NC(=O)N(C(=O)N1)C2=CC=CS2

Isomeric SMILES

CCC(CCC(=O)C)NC1=NC(=O)N(C(=O)N1)C2=CC=CS2

InChI

InChI=1S/C14H18N4O3S/c1-3-10(7-6-9(2)19)15-12-16-13(20)18(14(21)17-12)11-5-4-8-22-11/h4-5,8,10H,3,6-7H2,1-2H3,(H2,15,16,17,20,21)