N-[5-(aminocarbamoyl)-4-ethanoyl-cyclohexa-1,5-dien-1-yl]-3-[(3-fluorophenyl)carbamothioylamino]benzamide

Systemtic Name: N-[5-(aminocarbamoyl)-4-ethanoyl-cyclohexa-1,5-dien-1-yl]-3-[(3-fluorophenyl)carbamothioylamino]benzamide Openeye Name: N-[4-acetyl-5-(hydrazinecarbonyl)cyclohexa-1,5-dien-1-yl]-3-[(3-fluorophenyl)carbamothioylamino]benzamide CAS Name: N-[4-acetyl-5-(hydrazinecarbonyl)-1-cyclohexa-1,5-dienyl]-3-[[(3-fluoroanilino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-[4-acetyl-5-(hydrazinecarbonyl)cyclohexa-1,5-dien-1-yl]-3-[(3-fluorophenyl)carbamothioylamino]benzamide Traditional Name: N-(4-acetyl-5-carbazoyl-cyclohexa-1,5-dien-1-yl)-3-[(3-fluorophenyl)thiocarbamoylamino]benzamide Formula: C23H22FN5O3S MolecularWeight: 467.515883

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC=C(C=C1C(=O)NN)NC(=O)C2=CC(=CC=C2)NC(=S)NC3=CC(=CC=C3)F

Isomeric SMILES

CC(=O)C1CC=C(C=C1C(=O)NN)NC(=O)C2=CC(=CC=C2)NC(=S)NC3=CC(=CC=C3)F

InChI

InChI=1S/C23H22FN5O3S/c1-13(30)19-9-8-18(12-20(19)22(32)29-25)26-21(31)14-4-2-6-16(10-14)27-23(33)28-17-7-3-5-15(24)11-17/h2-8,10-12,19H,9,25H2,1H3,(H,26,31)(H,29,32)(H2,27,28,33)