2-azanyl-7,7-dimethyl-5-oxidanylidene-4-(4-propan-2-ylphenyl)-1-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-7,7-dimethyl-5-oxidanylidene-4-(4-propan-2-ylphenyl)-1-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-isopropylphenyl)-7,7-dimethyl-5-oxo-1-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-7,7-dimethyl-5-oxo-4-(4-propan-2-ylphenyl)-1-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-7,7-dimethyl-5-oxo-4-(4-propan-2-ylphenyl)-1-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-5-keto-7,7-dimethyl-4-p-cumenyl-1-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C26H31N5OS2 MolecularWeight: 493.68724

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=CC=C(C=C4)C(C)C)C(=O)CC(C3)(C)C

Isomeric SMILES

CCCSC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=CC=C(C=C4)C(C)C)C(=O)CC(C3)(C)C

InChI

InChI=1S/C26H31N5OS2/c1-6-11-33-25-30-29-24(34-25)31-19-12-26(4,5)13-20(32)22(19)21(18(14-27)23(31)28)17-9-7-16(8-10-17)15(2)3/h7-10,15,21H,6,11-13,28H2,1-5H3