4-[2-[(5-bromanylthiophen-3-yl)methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile

Systemtic Name: 4-[2-[(5-bromanylthiophen-3-yl)methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile Openeye Name: 4-[2-[(5-bromo-3-thienyl)methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile CAS Name: 4-[2-[(5-bromo-3-thiophenyl)methyl]-1-diazinanyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[2-[(5-bromothiophen-3-yl)methyl]diazinan-1-yl]naphthalene-1-carbonitrile Traditional Name: 4-[2-[(5-bromo-3-thienyl)methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile Formula: C20H18BrN3S MolecularWeight: 412.34602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(N(C1)CC2=CSC(=C2)Br)C3=CC=C(C4=CC=CC=C43)C#N

Isomeric SMILES

C1CCN(N(C1)CC2=CSC(=C2)Br)C3=CC=C(C4=CC=CC=C43)C#N

InChI

InChI=1S/C20H18BrN3S/c21-20-11-15(14-25-20)13-23-9-3-4-10-24(23)19-8-7-16(12-22)17-5-1-2-6-18(17)19/h1-2,5-8,11,14H,3-4,9-10,13H2