ethyl 2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(4,6-diamino-2-pyrimidinyl)thio]-1-oxoethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(4,6-diaminopyrimidin-2-yl)thio]acetyl]amino]-4-phenyl-thiazole-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=C(N=C(S1)NC(=O)CSC2=NC(=CC(=N2)N)N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC(=CC(=N2)N)N)C3=CC=CC=C3

InChI

InChI=1S/C18H18N6O3S2/c1-2-27-16(26)15-14(10-6-4-3-5-7-10)24-18(29-15)23-13(25)9-28-17-21-11(19)8-12(20)22-17/h3-8H,2,9H2,1H3,(H,23,24,25)(H4,19,20,21,22)