(2S)-N-aminocarbonyl-2-[6-(4-bromophenyl)thieno[3,2-d]pyrimidin-4-yl]sulfanyl-3-methyl-butanamide

Systemtic Name: (2S)-N-aminocarbonyl-2-[6-(4-bromophenyl)thieno[3,2-d]pyrimidin-4-yl]sulfanyl-3-methyl-butanamide Openeye Name: (2S)-2-[6-(4-bromophenyl)thieno[3,2-d]pyrimidin-4-yl]sulfanyl-N-carbamoyl-3-methyl-butanamide CAS Name: (2S)-2-[[6-(4-bromophenyl)-4-thieno[3,2-d]pyrimidinyl]thio]-N-carbamoyl-3-methylbutanamide IUPAC Name: (2S)-2-[6-(4-bromophenyl)thieno[3,2-d]pyrimidin-4-yl]sulfanyl-N-carbamoyl-3-methylbutanamide Traditional Name: (2S)-2-[[6-(4-bromophenyl)thieno[3,2-d]pyrimidin-4-yl]thio]-N-carbamoyl-3-methyl-butyramide Formula: C18H17BrN4O2S2 MolecularWeight: 465.38718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=NC=NC2=C1SC(=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)NC(=O)N)SC1=NC=NC2=C1SC(=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN4O2S2/c1-9(2)14(16(24)23-18(20)25)27-17-15-12(21-8-22-17)7-13(26-15)10-3-5-11(19)6-4-10/h3-9,14H,1-2H3,(H3,20,23,24,25)/t14-/m0/s1