2-azanyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(5-methyl-2-furyl)-5-oxo-1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(5-methyl-2-furanyl)-5-oxo-1-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(5-methylfuran-2-yl)-5-oxo-1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-5-keto-4-(5-methyl-2-furyl)-1-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C25H21N5O3S2 MolecularWeight: 503.59594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NN=C(S4)SCC(=O)C5=CC=CC=C5)N)C#N

Isomeric SMILES

CC1=CC=C(O1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NN=C(S4)SCC(=O)C5=CC=CC=C5)N)C#N

InChI

InChI=1S/C25H21N5O3S2/c1-14-10-11-20(33-14)21-16(12-26)23(27)30(17-8-5-9-18(31)22(17)21)24-28-29-25(35-24)34-13-19(32)15-6-3-2-4-7-15/h2-4,6-7,10-11,21H,5,8-9,13,27H2,1H3