N-[[4-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[[4-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[[4-(2-furylmethylcarbamoyl)phenyl]carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[4-[(2-furanylmethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[4-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[[4-(2-furfurylcarbamoyl)phenyl]thiocarbamoyl]-4-isopropyl-benzamide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O3S/c1-15(2)16-5-7-18(8-6-16)22(28)26-23(30)25-19-11-9-17(10-12-19)21(27)24-14-20-4-3-13-29-20/h3-13,15H,14H2,1-2H3,(H,24,27)(H2,25,26,28,30)