N-[3-[[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylanilino]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]anilino]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylanilino]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[4-[(4,6-dimethylpyrimidin-2-yl)thio]anilino]-3-keto-propyl]thiophene-3-carboxamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CCNC(=O)C3=CSC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CCNC(=O)C3=CSC=C3)C

InChI

InChI=1S/C20H20N4O2S2/c1-13-11-14(2)23-20(22-13)28-17-5-3-16(4-6-17)24-18(25)7-9-21-19(26)15-8-10-27-12-15/h3-6,8,10-12H,7,9H2,1-2H3,(H,21,26)(H,24,25)