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

Systemtic Name: 4-[2-[(5-pyridin-2-ylthiophen-2-yl)methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile Openeye Name: 4-[2-[[5-(2-pyridyl)-2-thienyl]methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile CAS Name: 4-[2-[[5-(2-pyridinyl)-2-thiophenyl]methyl]-1-diazinanyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[2-[(5-pyridin-2-ylthiophen-2-yl)methyl]diazinan-1-yl]naphthalene-1-carbonitrile Traditional Name: 4-[2-[[5-(2-pyridyl)-2-thienyl]methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile Formula: C25H22N4S MolecularWeight: 410.53398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(N(C1)CC2=CC=C(S2)C3=CC=CC=N3)C4=CC=C(C5=CC=CC=C54)C#N

Isomeric SMILES

C1CCN(N(C1)CC2=CC=C(S2)C3=CC=CC=N3)C4=CC=C(C5=CC=CC=C54)C#N

InChI

InChI=1S/C25H22N4S/c26-17-19-10-12-24(22-8-2-1-7-21(19)22)29-16-6-5-15-28(29)18-20-11-13-25(30-20)23-9-3-4-14-27-23/h1-4,7-14H,5-6,15-16,18H2