N-(4-dimethylaminophenyl)-4-[furan-2-ylmethyl-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl]amino]thiane-4-carboxamide

Systemtic Name: N-(4-dimethylaminophenyl)-4-[furan-2-ylmethyl-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl]amino]thiane-4-carboxamide Openeye Name: N-(4-dimethylaminophenyl)-4-[2-furylmethyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]tetrahydrothiopyran-4-carboxamide CAS Name: N-(4-dimethylaminophenyl)-4-[2-furanylmethyl-[1-oxo-2-(4-phenyl-2-sulfanylidene-1-imidazolidinyl)ethyl]amino]-4-thianecarboxamide IUPAC Name: N-(4-dimethylaminophenyl)-4-[furan-2-ylmethyl-[2-(4-phenyl-2-sulfanylideneimidazolidin-1-yl)acetyl]amino]thiane-4-carboxamide Traditional Name: N-(4-dimethylaminophenyl)-4-[2-furfuryl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]tetrahydrothiopyran-4-carboxamide Formula: C30H35N5O3S2 MolecularWeight: 577.7606

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)C2(CCSCC2)N(CC3=CC=CO3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)C2(CCSCC2)N(CC3=CC=CO3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5

InChI

InChI=1S/C30H35N5O3S2/c1-33(2)24-12-10-23(11-13-24)31-28(37)30(14-17-40-18-15-30)35(19-25-9-6-16-38-25)27(36)21-34-20-26(32-29(34)39)22-7-4-3-5-8-22/h3-13,16,26H,14-15,17-21H2,1-2H3,(H,31,37)(H,32,39)