2-[(2,6-dimethylphenyl)carbamothioylamino]-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 2-[(2,6-dimethylphenyl)carbamothioylamino]-N-(furan-2-ylmethyl)benzamide Openeye Name: 2-[(2,6-dimethylphenyl)carbamothioylamino]-N-(2-furylmethyl)benzamide CAS Name: 2-[[(2,6-dimethylanilino)-sulfanylidenemethyl]amino]-N-(2-furanylmethyl)benzamide IUPAC Name: 2-[(2,6-dimethylphenyl)carbamothioylamino]-N-(furan-2-ylmethyl)benzamide Traditional Name: 2-[(2,6-dimethylphenyl)thiocarbamoylamino]-N-(2-furfuryl)benzamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H21N3O2S/c1-14-7-5-8-15(2)19(14)24-21(27)23-18-11-4-3-10-17(18)20(25)22-13-16-9-6-12-26-16/h3-12H,13H2,1-2H3,(H,22,25)(H2,23,24,27)