2-[[(E)-(3-methyl-1-naphthalen-1-yl-5-oxidanylidene-pyrazol-4-ylidene)methyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile

Systemtic Name: 2-[[(E)-(3-methyl-1-naphthalen-1-yl-5-oxidanylidene-pyrazol-4-ylidene)methyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile Openeye Name: 2-[[(E)-[3-methyl-1-(1-naphthyl)-5-oxo-pyrazol-4-ylidene]methyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile CAS Name: 2-[[(E)-[3-methyl-1-(1-naphthalenyl)-5-oxo-4-pyrazolylidene]methyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile IUPAC Name: 2-[[(E)-(3-methyl-1-naphthalen-1-yl-5-oxopyrazol-4-ylidene)methyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile Traditional Name: 2-[[(E)-[5-keto-3-methyl-1-(1-naphthyl)-2-pyrazolin-4-ylidene]methyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile Formula: C23H18N4OS MolecularWeight: 398.48022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=C(C3=C(S2)CCC3)C#N)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NC2=C(C3=C(S2)CCC3)C#N)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H18N4OS/c1-14-19(13-25-22-18(12-24)17-9-5-11-21(17)29-22)23(28)27(26-14)20-10-4-7-15-6-2-3-8-16(15)20/h2-4,6-8,10,13,25H,5,9,11H2,1H3/b19-13+