2-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[[(E)-3-(2-furyl)prop-2-enoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[[(E)-3-(2-furyl)acryloyl]thiocarbamoylamino]-N-(1-phenylethyl)benzamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C=CC3=CC=CO3

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)/C=C/C3=CC=CO3

InChI

InChI=1S/C23H21N3O3S/c1-16(17-8-3-2-4-9-17)24-22(28)19-11-5-6-12-20(19)25-23(30)26-21(27)14-13-18-10-7-15-29-18/h2-16H,1H3,(H,24,28)(H2,25,26,27,30)/b14-13+