4-azanyl-3-(phenylmethyl)-1H-quinazolin-3-ium-2-thione

Systemtic Name: 4-azanyl-3-(phenylmethyl)-1H-quinazolin-3-ium-2-thione Openeye Name: 4-amino-3-benzyl-1H-quinazolin-3-ium-2-thione CAS Name: 4-amino-3-(phenylmethyl)-1H-quinazolin-3-ium-2-thione IUPAC Name: 4-amino-3-benzyl-1H-quinazolin-3-ium-2-thione Traditional Name: 4-amino-3-benzyl-1H-quinazolin-3-ium-2-thione Formula: C15H14N3S+ MolecularWeight: 268.35676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(C3=CC=CC=C3NC2=S)N

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(C3=CC=CC=C3NC2=S)N

InChI

InChI=1S/C15H13N3S/c16-14-12-8-4-5-9-13(12)17-15(19)18(14)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,16,17,19)/p+1