ethyl 2-[1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-4-azanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-4-azanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[(3-carbamoyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[1-[(3-carbamoyl-2-thiophenyl)amino]-1-oxopropan-2-yl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[1-[(3-carbamoylthiophen-2-yl)amino]-1-oxopropan-2-yl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[(3-carbamoyl-2-thienyl)amino]-2-keto-1-methyl-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C15H17N5O4S2 MolecularWeight: 395.45658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SC(C)C(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SC(C)C(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C15H17N5O4S2/c1-3-24-14(23)9-6-18-15(19-10(9)16)26-7(2)12(22)20-13-8(11(17)21)4-5-25-13/h4-7H,3H2,1-2H3,(H2,17,21)(H,20,22)(H2,16,18,19)