4-[[[4-(1,3-dithian-2-yl)phenyl]carbonyl-(furan-2-ylmethyl)amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[[4-(1,3-dithian-2-yl)phenyl]carbonyl-(furan-2-ylmethyl)amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[4-(1,3-dithian-2-yl)benzoyl]-(2-furylmethyl)amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]-(2-furanylmethyl)amino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[4-(1,3-dithian-2-yl)benzoyl]-(furan-2-ylmethyl)amino]methyl]-N-methylbenzamide Traditional Name: 4-[[[4-(1,3-dithian-2-yl)benzoyl]-(2-furfuryl)amino]methyl]-N-methyl-benzamide Formula: C25H26N2O3S2 MolecularWeight: 466.61554

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)C(=O)C3=CC=C(C=C3)C4SCCCS4

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)C(=O)C3=CC=C(C=C3)C4SCCCS4

InChI

InChI=1S/C25H26N2O3S2/c1-26-23(28)19-7-5-18(6-8-19)16-27(17-22-4-2-13-30-22)24(29)20-9-11-21(12-10-20)25-31-14-3-15-32-25/h2,4-13,25H,3,14-17H2,1H3,(H,26,28)