N-[8-(phenylmethylsulfanyl)octyl]quinazolin-4-amine

Systemtic Name: N-[8-(phenylmethylsulfanyl)octyl]quinazolin-4-amine Openeye Name: N-(8-benzylsulfanyloctyl)quinazolin-4-amine CAS Name: N-[8-(phenylmethylthio)octyl]-4-quinazolinamine IUPAC Name: N-(8-benzylsulfanyloctyl)quinazolin-4-amine Traditional Name: 8-(benzylthio)octyl-quinazolin-4-yl-amine Formula: C23H29N3S MolecularWeight: 379.56146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCCCCCCCNC2=NC=NC3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)CSCCCCCCCCNC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C23H29N3S/c1(2-4-11-17-27-18-20-12-6-5-7-13-20)3-10-16-24-23-21-14-8-9-15-22(21)25-19-26-23/h5-9,12-15,19H,1-4,10-11,16-18H2,(H,24,25,26)