N-[[(2S)-butan-2-yl]carbamoyl]-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-[[(1S)-1-methylpropyl]carbamoyl]-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-[[(1S)-1-methylpropyl]carbamoyl]-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetamide Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)CSC1=NC=NC2=C1C=C(S2)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)CSC1=NC=NC2=C1C=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2S2/c1-3-12(2)22-19(25)23-16(24)10-26-17-14-9-15(13-7-5-4-6-8-13)27-18(14)21-11-20-17/h4-9,11-12H,3,10H2,1-2H3,(H2,22,23,24,25)/t12-/m0/s1