N-(1,3-benzodioxol-5-ylmethyl)-2-ethylsulfanyl-quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethylsulfanyl-quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethylsulfanyl-quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(ethylthio)-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethylsulfanylquinazolin-4-amine Traditional Name: [2-(ethylthio)quinazolin-4-yl]-piperonyl-amine Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=CC=CC=C2C(=N1)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCSC1=NC2=CC=CC=C2C(=N1)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17N3O2S/c1-2-24-18-20-14-6-4-3-5-13(14)17(21-18)19-10-12-7-8-15-16(9-12)23-11-22-15/h3-9H,2,10-11H2,1H3,(H,19,20,21)