N-[4-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]phenyl]propanamide

Systemtic Name: N-[4-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]phenyl]propanamide Openeye Name: N-[4-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]phenyl]propanamide CAS Name: N-[4-[[2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: N-[4-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]phenyl]propanamide Traditional Name: N-[4-[[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]phenyl]propionamide Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2C(=C(S3)C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2C(=C(S3)C)C

InChI

InChI=1S/C19H20N4O2S2/c1-4-15(24)22-13-5-7-14(8-6-13)23-16(25)9-26-18-17-11(2)12(3)27-19(17)21-10-20-18/h5-8,10H,4,9H2,1-3H3,(H,22,24)(H,23,25)