2-(1,3-benzothiazol-2-ylsulfanylmethyl)quinazolin-4-amine

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)quinazolin-4-amine Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)quinazolin-4-amine CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-4-quinazolinamine IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)quinazolin-4-amine Traditional Name: [2-[(1,3-benzothiazol-2-ylthio)methyl]quinazolin-4-yl]amine Formula: C16H12N4S2 MolecularWeight: 324.42328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=NC4=CC=CC=C4S3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=NC4=CC=CC=C4S3)N

InChI

InChI=1S/C16H12N4S2/c17-15-10-5-1-2-6-11(10)18-14(20-15)9-21-16-19-12-7-3-4-8-13(12)22-16/h1-8H,9H2,(H2,17,18,20)