6-iodanyl-N-[4-(1,2,4-triazol-1-yl)phenyl]quinazolin-4-amine

Systemtic Name: 6-iodanyl-N-[4-(1,2,4-triazol-1-yl)phenyl]quinazolin-4-amine Openeye Name: 6-iodo-N-[4-(1,2,4-triazol-1-yl)phenyl]quinazolin-4-amine CAS Name: 6-iodo-N-[4-(1,2,4-triazol-1-yl)phenyl]-4-quinazolinamine IUPAC Name: 6-iodo-N-[4-(1,2,4-triazol-1-yl)phenyl]quinazolin-4-amine Traditional Name: (6-iodoquinazolin-4-yl)-[4-(1,2,4-triazol-1-yl)phenyl]amine Formula: C16H11IN6 MolecularWeight: 414.20321

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=NC3=C2C=C(C=C3)I)N4C=NC=N4

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=NC3=C2C=C(C=C3)I)N4C=NC=N4

InChI

InChI=1S/C16H11IN6/c17-11-1-6-15-14(7-11)16(20-9-19-15)22-12-2-4-13(5-3-12)23-10-18-8-21-23/h1-10H,(H,19,20,22)