ethyl 4-azanyl-2-[4-azanyl-3-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]phenyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[4-azanyl-3-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]phenyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[4-amino-3-[(4-methylthiazol-2-yl)carbamoyl]phenyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[4-amino-3-[[(4-methyl-2-thiazolyl)amino]-oxomethyl]phenyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[4-amino-3-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]phenyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[4-amino-3-[(4-methylthiazol-2-yl)carbamoyl]phenyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H18N6O3S2 MolecularWeight: 430.50392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SC2=CC(=C(C=C2)N)C(=O)NC3=NC(=CS3)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SC2=CC(=C(C=C2)N)C(=O)NC3=NC(=CS3)C

InChI

InChI=1S/C18H18N6O3S2/c1-3-27-16(26)12-7-21-17(23-14(12)20)29-10-4-5-13(19)11(6-10)15(25)24-18-22-9(2)8-28-18/h4-8H,3,19H2,1-2H3,(H2,20,21,23)(H,22,24,25)