8-azanyl-7-[4-(4-methylphenyl)thiophen-2-yl]-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-diene-11-carbonitrile

Systemtic Name: 8-azanyl-7-[4-(4-methylphenyl)thiophen-2-yl]-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-diene-11-carbonitrile Openeye Name: 8-amino-7-[4-(p-tolyl)-2-thienyl]-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-diene-11-carbonitrile CAS Name: 8-amino-10-mercapto-7-[4-(4-methylphenyl)-2-thiophenyl]-9-azaspiro[5.5]undeca-8,10-diene-11-carbonitrile IUPAC Name: 8-amino-7-[4-(4-methylphenyl)thiophen-2-yl]-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-diene-11-carbonitrile Traditional Name: 8-amino-10-mercapto-7-[4-(p-tolyl)-2-thienyl]-9-azaspiro[5.5]undeca-8,10-diene-11-carbonitrile Formula: C22H23N3S2 MolecularWeight: 393.56812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2)C3C(=NC(=C(C34CCCCC4)C#N)S)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2)C3C(=NC(=C(C34CCCCC4)C#N)S)N

InChI

InChI=1S/C22H23N3S2/c1-14-5-7-15(8-6-14)16-11-18(27-13-16)19-20(24)25-21(26)17(12-23)22(19)9-3-2-4-10-22/h5-8,11,13,19,26H,2-4,9-10H2,1H3,(H2,24,25)