N-[(1S)-2-(tert-butylamino)-1-(5-methylfuran-2-yl)-2-oxidanylidene-ethyl]-N-cyclopentyl-5-phenyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[(1S)-2-(tert-butylamino)-1-(5-methylfuran-2-yl)-2-oxidanylidene-ethyl]-N-cyclopentyl-5-phenyl-1H-pyrrole-2-carboxamide Openeye Name: N-[(1S)-2-(tert-butylamino)-1-(5-methyl-2-furyl)-2-oxo-ethyl]-N-cyclopentyl-5-phenyl-1H-pyrrole-2-carboxamide CAS Name: N-[(1S)-2-(tert-butylamino)-1-(5-methyl-2-furanyl)-2-oxoethyl]-N-cyclopentyl-5-phenyl-1H-pyrrole-2-carboxamide IUPAC Name: N-[(1S)-2-(tert-butylamino)-1-(5-methylfuran-2-yl)-2-oxoethyl]-N-cyclopentyl-5-phenyl-1H-pyrrole-2-carboxamide Traditional Name: N-[(1S)-2-(tert-butylamino)-2-keto-1-(5-methyl-2-furyl)ethyl]-N-cyclopentyl-5-phenyl-1H-pyrrole-2-carboxamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C(=O)NC(C)(C)C)N(C2CCCC2)C(=O)C3=CC=C(N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)[C@@H](C(=O)NC(C)(C)C)N(C2CCCC2)C(=O)C3=CC=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C27H33N3O3/c1-18-14-17-23(33-18)24(25(31)29-27(2,3)4)30(20-12-8-9-13-20)26(32)22-16-15-21(28-22)19-10-6-5-7-11-19/h5-7,10-11,14-17,20,24,28H,8-9,12-13H2,1-4H3,(H,29,31)/t24-/m0/s1