7-azanyl-9-[(2-methylphenyl)methylsulfanyl]-8-azaspiro[4.5]deca-7,9-diene-6,10-dicarbonitrile

Systemtic Name: 7-azanyl-9-[(2-methylphenyl)methylsulfanyl]-8-azaspiro[4.5]deca-7,9-diene-6,10-dicarbonitrile Openeye Name: 7-amino-9-(o-tolylmethylsulfanyl)-8-azaspiro[4.5]deca-7,9-diene-6,10-dicarbonitrile CAS Name: 7-amino-9-[(2-methylphenyl)methylthio]-8-azaspiro[4.5]deca-7,9-diene-6,10-dicarbonitrile IUPAC Name: 7-amino-9-[(2-methylphenyl)methylsulfanyl]-8-azaspiro[4.5]deca-7,9-diene-6,10-dicarbonitrile Traditional Name: 7-amino-9-[(2-methylbenzyl)thio]-8-azaspiro[4.5]deca-7,9-diene-6,10-dicarbonitrile Formula: C19H20N4S MolecularWeight: 336.4539

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C3(CCCC3)C(C(=N2)N)C#N)C#N

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C3(CCCC3)C(C(=N2)N)C#N)C#N

InChI

InChI=1S/C19H20N4S/c1-13-6-2-3-7-14(13)12-24-18-16(11-21)19(8-4-5-9-19)15(10-20)17(22)23-18/h2-3,6-7,15H,4-5,8-9,12H2,1H3,(H2,22,23)