N-[1-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[1-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-[(1,3-diphenylpyrazol-4-yl)methylcarbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[1-[(1,3-diphenyl-4-pyrazolyl)methylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[1-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-[(1,3-diphenylpyrazol-4-yl)methylcarbamoyl]-3-(methylthio)propyl]benzamide Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CSCCC(C(=O)NCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H28N4O2S/c1-35-18-17-25(30-27(33)22-13-7-3-8-14-22)28(34)29-19-23-20-32(24-15-9-4-10-16-24)31-26(23)21-11-5-2-6-12-21/h2-16,20,25H,17-19H2,1H3,(H,29,34)(H,30,33)