N-(furan-2-ylmethyl)-3-[(4-methoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-3-[(4-methoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(2-furylmethyl)-3-[(4-methoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-3-[[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-3-[(4-methoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-3-(p-anisoylthiocarbamoylamino)benzamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H19N3O4S/c1-27-17-9-7-14(8-10-17)20(26)24-21(29)23-16-5-2-4-15(12-16)19(25)22-13-18-6-3-11-28-18/h2-12H,13H2,1H3,(H,22,25)(H2,23,24,26,29)