(2S)-2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-naphthalen-1-yl-propanamide

Systemtic Name: (2S)-2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-naphthalen-1-yl-propanamide Openeye Name: (2S)-2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-(1-naphthyl)propanamide CAS Name: (2S)-2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-(1-naphthalenyl)propanamide IUPAC Name: (2S)-2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-naphthalen-1-ylpropanamide Traditional Name: (2S)-2-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-(1-naphthyl)propionamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C)C(=O)NC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CS[C@@H](C)C(=O)NC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C22H21N3O2S2/c1-12-13(2)29-22-19(12)21(27)24-18(25-22)11-28-14(3)20(26)23-17-10-6-8-15-7-4-5-9-16(15)17/h4-10,14H,11H2,1-3H3,(H,23,26)(H,24,25,27)/t14-/m0/s1