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

Systemtic Name: 2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-phenethyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-phenethyl-propanamide CAS Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-phenethyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-phenethylpropanamide Traditional Name: N-benzyl-2-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-phenethyl-propionamide Formula: C27H29N3O2S2 MolecularWeight: 491.66806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C27H29N3O2S2/c1-18-19(2)34-26-24(18)25(31)28-23(29-26)17-33-20(3)27(32)30(16-22-12-8-5-9-13-22)15-14-21-10-6-4-7-11-21/h4-13,20H,14-17H2,1-3H3,(H,28,29,31)