methyl 5-[tert-butyl-[2-(tert-butylamino)ethyl]amino]-4-phenyl-2-thiophen-2-yl-furan-3-carboxylate

Systemtic Name: methyl 5-[tert-butyl-[2-(tert-butylamino)ethyl]amino]-4-phenyl-2-thiophen-2-yl-furan-3-carboxylate Openeye Name: methyl 5-[tert-butyl-[2-(tert-butylamino)ethyl]amino]-4-phenyl-2-(2-thienyl)furan-3-carboxylate CAS Name: 5-[tert-butyl-[2-(tert-butylamino)ethyl]amino]-4-phenyl-2-thiophen-2-yl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[tert-butyl-[2-(tert-butylamino)ethyl]amino]-4-phenyl-2-thiophen-2-ylfuran-3-carboxylate Traditional Name: 5-[tert-butyl-[2-(tert-butylamino)ethyl]amino]-4-phenyl-2-(2-thienyl)furan-3-carboxylic acid methyl ester Formula: C26H34N2O3S MolecularWeight: 454.62476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCCN(C1=C(C(=C(O1)C2=CC=CS2)C(=O)OC)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC(C)(C)NCCN(C1=C(C(=C(O1)C2=CC=CS2)C(=O)OC)C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C26H34N2O3S/c1-25(2,3)27-15-16-28(26(4,5)6)23-20(18-12-9-8-10-13-18)21(24(29)30-7)22(31-23)19-14-11-17-32-19/h8-14,17,27H,15-16H2,1-7H3