N-(phenylmethyl)-5-(thieno[3,2-d]pyrimidin-4-ylsulfanylmethyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(phenylmethyl)-5-(thieno[3,2-d]pyrimidin-4-ylsulfanylmethyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-benzyl-5-(thieno[3,2-d]pyrimidin-4-ylsulfanylmethyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(phenylmethyl)-5-[(4-thieno[3,2-d]pyrimidinylthio)methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-benzyl-5-(thieno[3,2-d]pyrimidin-4-ylsulfanylmethyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-benzyl-5-[(thieno[3,2-d]pyrimidin-4-ylthio)methyl]-1,3,4-thiadiazole-2-carboxamide Formula: C17H13N5OS3 MolecularWeight: 399.51302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=NN=C(S2)CSC3=NC=NC4=C3SC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=NN=C(S2)CSC3=NC=NC4=C3SC=C4

InChI

InChI=1S/C17H13N5OS3/c23-15(18-8-11-4-2-1-3-5-11)17-22-21-13(26-17)9-25-16-14-12(6-7-24-14)19-10-20-16/h1-7,10H,8-9H2,(H,18,23)