5-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-butyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-butyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-butyl-1,3,4-thiadiazol-2-amine CAS Name: 5-(4-benzofuro[3,2-d]pyrimidinylthio)-N-butyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-butyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-(benzofuro[3,2-d]pyrimidin-4-ylthio)-1,3,4-thiadiazol-2-yl]-butyl-amine Formula: C16H15N5OS2 MolecularWeight: 357.4532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SC2=NC=NC3=C2OC4=CC=CC=C43

Isomeric SMILES

CCCCNC1=NN=C(S1)SC2=NC=NC3=C2OC4=CC=CC=C43

InChI

InChI=1S/C16H15N5OS2/c1-2-3-8-17-15-20-21-16(24-15)23-14-13-12(18-9-19-14)10-6-4-5-7-11(10)22-13/h4-7,9H,2-3,8H2,1H3,(H,17,20)