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

Systemtic Name: 4-[2-[(5-bromanylthiophen-2-yl)methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile Openeye Name: 4-[2-[(5-bromo-2-thienyl)methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile CAS Name: 4-[2-[(5-bromo-2-thiophenyl)methyl]-1-diazinanyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[2-[(5-bromothiophen-2-yl)methyl]diazinan-1-yl]naphthalene-1-carbonitrile Traditional Name: 4-[2-[(5-bromo-2-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=CC=C(S2)Br)C3=CC=C(C4=CC=CC=C43)C#N

Isomeric SMILES

C1CCN(N(C1)CC2=CC=C(S2)Br)C3=CC=C(C4=CC=CC=C43)C#N

InChI

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