4-azanylidene-3-(4-bromophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2-thione

Systemtic Name: 4-azanylidene-3-(4-bromophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2-thione Openeye Name: 3-(4-bromophenyl)-4-imino-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2-thione CAS Name: 3-(4-bromophenyl)-4-imino-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2-thione IUPAC Name: 3-(4-bromophenyl)-4-imino-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2-thione Traditional Name: 3-(4-bromophenyl)-4-imino-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2-thione Formula: C14H16BrN3S MolecularWeight: 338.26594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(=N)N(C(=S)N2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC2C(C1)C(=N)N(C(=S)N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C14H16BrN3S/c15-9-5-7-10(8-6-9)18-13(16)11-3-1-2-4-12(11)17-14(18)19/h5-8,11-12,16H,1-4H2,(H,17,19)