3-[bis(propylsulfanyl)methyl]-1-(phenoxymethyl)-2,4-dihydroquinazoline hydrochloride

Systemtic Name: 3-[bis(propylsulfanyl)methyl]-1-(phenoxymethyl)-2,4-dihydroquinazoline hydrochloride Openeye Name: 3-[bis(propylsulfanyl)methyl]-1-(phenoxymethyl)-2,4-dihydroquinazoline hydrochloride CAS Name: 3-[bis(propylthio)methyl]-1-(phenoxymethyl)-2,4-dihydroquinazoline hydrochloride IUPAC Name: 3-[bis(propylsulfanyl)methyl]-1-(phenoxymethyl)-2,4-dihydroquinazoline hydrochloride Traditional Name: 3-[bis(propylthio)methyl]-1-(phenoxymethyl)-2,4-dihydroquinazoline hydrochloride Formula: C22H31ClN2OS2 MolecularWeight: 439.07734

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(N1CC2=CC=CC=C2N(C1)COC3=CC=CC=C3)SCCC.Cl

Isomeric SMILES

CCCSC(N1CC2=CC=CC=C2N(C1)COC3=CC=CC=C3)SCCC.Cl

InChI

InChI=1S/C22H30N2OS2.ClH/c1-3-14-26-22(27-15-4-2)23-16-19-10-8-9-13-21(19)24(17-23)18-25-20-11-6-5-7-12-20;/h5-13,22H,3-4,14-18H2,1-2H3;1H