3-azanylidene-2-phenyl-1-sulfanylidene-6,7,8,9,10,11-hexahydro-5H-pyrimido[1,6-a]azonine-4-carbonitrile

Systemtic Name: 3-azanylidene-2-phenyl-1-sulfanylidene-6,7,8,9,10,11-hexahydro-5H-pyrimido[1,6-a]azonine-4-carbonitrile Openeye Name: 3-imino-2-phenyl-1-thioxo-6,7,8,9,10,11-hexahydro-5H-pyrimido[1,6-a]azonine-4-carbonitrile CAS Name: 3-imino-2-phenyl-1-sulfanylidene-6,7,8,9,10,11-hexahydro-5H-pyrimido[1,6-a]azonine-4-carbonitrile IUPAC Name: 3-imino-2-phenyl-1-sulfanylidene-6,7,8,9,10,11-hexahydro-5H-pyrimido[1,6-a]azonine-4-carbonitrile Traditional Name: 3-imino-2-phenyl-1-thioxo-6,7,8,9,10,11-hexahydro-5H-pyrimid[1,6-a]azonine-4-carbonitrile Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(C(=N)N(C(=S)N2CCC1)C3=CC=CC=C3)C#N

Isomeric SMILES

C1CCCC2=C(C(=N)N(C(=S)N2CCC1)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H20N4S/c19-13-15-16-11-7-2-1-3-8-12-21(16)18(23)22(17(15)20)14-9-5-4-6-10-14/h4-6,9-10,20H,1-3,7-8,11-12H2