3-(3-bromophenyl)-5-oxidanylidene-1-propyl-2-(1,2,4-triazin-6-yl)cyclopentane-1-carboxamide

Systemtic Name: 3-(3-bromophenyl)-5-oxidanylidene-1-propyl-2-(1,2,4-triazin-6-yl)cyclopentane-1-carboxamide Openeye Name: 3-(3-bromophenyl)-5-oxo-1-propyl-2-(1,2,4-triazin-6-yl)cyclopentanecarboxamide CAS Name: 3-(3-bromophenyl)-5-oxo-1-propyl-2-(1,2,4-triazin-6-yl)-1-cyclopentanecarboxamide IUPAC Name: 3-(3-bromophenyl)-5-oxo-1-propyl-2-(1,2,4-triazin-6-yl)cyclopentane-1-carboxamide Traditional Name: 3-(3-bromophenyl)-5-keto-1-propyl-2-(1,2,4-triazin-6-yl)cyclopentanecarboxamide Formula: C18H19BrN4O2 MolecularWeight: 403.27306

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(C(CC1=O)C2=CC(=CC=C2)Br)C3=CN=CN=N3)C(=O)N

Isomeric SMILES

CCCC1(C(C(CC1=O)C2=CC(=CC=C2)Br)C3=CN=CN=N3)C(=O)N

InChI

InChI=1S/C18H19BrN4O2/c1-2-6-18(17(20)25)15(24)8-13(11-4-3-5-12(19)7-11)16(18)14-9-21-10-22-23-14/h3-5,7,9-10,13,16H,2,6,8H2,1H3,(H2,20,25)