2-azanyl-1-[5-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-(3-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-[5-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-(3-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-[5-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-(3-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-[5-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-4-(3-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-(3-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-[5-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-5-keto-4-(3-methoxyphenyl)-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C29H26ClN5O3S2 MolecularWeight: 592.13144

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)C4=CC=C(C=C4)Cl)N)C#N)C5=CC(=CC=C5)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)C4=CC=C(C=C4)Cl)N)C#N)C5=CC(=CC=C5)OC)C(=O)C1)C

InChI

InChI=1S/C29H26ClN5O3S2/c1-29(2)12-21-25(22(36)13-29)24(17-5-4-6-19(11-17)38-3)20(14-31)26(32)35(21)27-33-34-28(40-27)39-15-23(37)16-7-9-18(30)10-8-16/h4-11,24H,12-13,15,32H2,1-3H3