4-azanyl-3-[(4-chlorophenyl)methyl]-1H-quinazolin-3-ium-2-thione

Systemtic Name: 4-azanyl-3-[(4-chlorophenyl)methyl]-1H-quinazolin-3-ium-2-thione Openeye Name: 4-amino-3-[(4-chlorophenyl)methyl]-1H-quinazolin-3-ium-2-thione CAS Name: 4-amino-3-[(4-chlorophenyl)methyl]-1H-quinazolin-3-ium-2-thione IUPAC Name: 4-amino-3-[(4-chlorophenyl)methyl]-1H-quinazolin-3-ium-2-thione Traditional Name: 4-amino-3-(4-chlorobenzyl)-1H-quinazolin-3-ium-2-thione Formula: C15H13ClN3S+ MolecularWeight: 302.80182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=[N+](C(=S)N2)CC3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=[N+](C(=S)N2)CC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C15H12ClN3S/c16-11-7-5-10(6-8-11)9-19-14(17)12-3-1-2-4-13(12)18-15(19)20/h1-8H,9H2,(H2,17,18,20)/p+1