1-(3-methyl-4-naphthalen-2-ylcarbonyl-piperazin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(3-methyl-4-naphthalen-2-ylcarbonyl-piperazin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-[3-methyl-4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-[3-methyl-4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-[3-methyl-4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-[3-methyl-4-(2-naphthoyl)piperazino]-2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C30H27N5O2S2 MolecularWeight: 553.69768

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC3=CC=CC=C3C=C2)C(=O)CSC4=NN=C(N4C5=CC=CC=C5)C6=CC=CS6

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC3=CC=CC=C3C=C2)C(=O)CSC4=NN=C(N4C5=CC=CC=C5)C6=CC=CS6

InChI

InChI=1S/C30H27N5O2S2/c1-21-19-33(15-16-34(21)29(37)24-14-13-22-8-5-6-9-23(22)18-24)27(36)20-39-30-32-31-28(26-12-7-17-38-26)35(30)25-10-3-2-4-11-25/h2-14,17-18,21H,15-16,19-20H2,1H3