[5-azanyl-6-azanylidene-3-[(4-bromophenyl)amino]-1,2,4-triazin-1-yl]-phenyl-methanone

Systemtic Name: [5-azanyl-6-azanylidene-3-[(4-bromophenyl)amino]-1,2,4-triazin-1-yl]-phenyl-methanone Openeye Name: [5-amino-3-(4-bromoanilino)-6-imino-1,2,4-triazin-1-yl]-phenyl-methanone CAS Name: [5-amino-3-(4-bromoanilino)-6-imino-1,2,4-triazin-1-yl]-phenylmethanone IUPAC Name: [5-amino-3-(4-bromoanilino)-6-imino-1,2,4-triazin-1-yl]-phenylmethanone Traditional Name: [5-amino-3-(4-bromoanilino)-6-imino-1,2,4-triazin-1-yl]-phenyl-methanone Formula: C16H13BrN6O MolecularWeight: 385.21802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N2C(=N)C(=NC(=N2)NC3=CC=C(C=C3)Br)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N2C(=N)C(=NC(=N2)NC3=CC=C(C=C3)Br)N

InChI

InChI=1S/C16H13BrN6O/c17-11-6-8-12(9-7-11)20-16-21-13(18)14(19)23(22-16)15(24)10-4-2-1-3-5-10/h1-9,19H,(H3,18,20,21,22)