2-(2-azanylethylsulfanylmethyl)-7-chloranyl-1H-quinazolin-4-one

Systemtic Name: 2-(2-azanylethylsulfanylmethyl)-7-chloranyl-1H-quinazolin-4-one Openeye Name: 2-(2-aminoethylsulfanylmethyl)-7-chloro-1H-quinazolin-4-one CAS Name: 2-[(2-aminoethylthio)methyl]-7-chloro-1H-quinazolin-4-one IUPAC Name: 2-(2-aminoethylsulfanylmethyl)-7-chloro-1H-quinazolin-4-one Traditional Name: 2-[(2-aminoethylthio)methyl]-7-chloro-1H-quinazolin-4-one Formula: C11H12ClN3OS MolecularWeight: 269.75048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC(=NC2=O)CSCCN

Isomeric SMILES

C1=CC2=C(C=C1Cl)NC(=NC2=O)CSCCN

InChI

InChI=1S/C11H12ClN3OS/c12-7-1-2-8-9(5-7)14-10(15-11(8)16)6-17-4-3-13/h1-2,5H,3-4,6,13H2,(H,14,15,16)