2-azanyl-4-(2,4-dichlorophenyl)-1-[5-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2,4-dichlorophenyl)-1-[5-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(2,4-dichlorophenyl)-1-[5-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(2,4-dichlorophenyl)-1-[5-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2,4-dichlorophenyl)-1-[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(2,4-dichlorophenyl)-5-keto-1-[5-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C27H21Cl2N5O3S2 MolecularWeight: 598.52334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)N3C4=C(C(C(=C3N)C#N)C5=C(C=C(C=C5)Cl)Cl)C(=O)CCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)N3C4=C(C(C(=C3N)C#N)C5=C(C=C(C=C5)Cl)Cl)C(=O)CCC4

InChI

InChI=1S/C27H21Cl2N5O3S2/c1-37-16-8-5-14(6-9-16)22(36)13-38-27-33-32-26(39-27)34-20-3-2-4-21(35)24(20)23(18(12-30)25(34)31)17-10-7-15(28)11-19(17)29/h5-11,23H,2-4,13,31H2,1H3