methyl 4-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]carbamothioylamino]benzoate

Systemtic Name: methyl 4-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]carbamothioylamino]benzoate Openeye Name: methyl 4-[[(E)-3-(5-methyl-2-furyl)prop-2-enoyl]carbamothioylamino]benzoate CAS Name: 4-[[[[(E)-3-(5-methyl-2-furanyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]carbamothioylamino]benzoate Traditional Name: 4-[[(E)-3-(5-methyl-2-furyl)acryloyl]thiocarbamoylamino]benzoic acid methyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(O1)/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H16N2O4S/c1-11-3-8-14(23-11)9-10-15(20)19-17(24)18-13-6-4-12(5-7-13)16(21)22-2/h3-10H,1-2H3,(H2,18,19,20,24)/b10-9+