8-(2-ethylsulfanylpyridin-3-yl)carbonyl-N-(phenylmethyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-ene-2-carboxamide

Systemtic Name: 8-(2-ethylsulfanylpyridin-3-yl)carbonyl-N-(phenylmethyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-ene-2-carboxamide Openeye Name: N-benzyl-8-(2-ethylsulfanylpyridine-3-carbonyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-ene-2-carboxamide CAS Name: 8-[[2-(ethylthio)-3-pyridinyl]-oxomethyl]-N-(phenylmethyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-ene-2-carboxamide IUPAC Name: N-benzyl-8-(2-ethylsulfanylpyridine-3-carbonyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-ene-2-carboxamide Traditional Name: N-benzyl-8-[2-(ethylthio)nicotinoyl]-4-oxa-3,8-diazaspiro[4.5]dec-2-ene-2-carboxamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CC=N1)C(=O)N2CCC3(CC2)CC(=NO3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCSC1=C(C=CC=N1)C(=O)N2CCC3(CC2)CC(=NO3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3S/c1-2-31-21-18(9-6-12-24-21)22(29)27-13-10-23(11-14-27)15-19(26-30-23)20(28)25-16-17-7-4-3-5-8-17/h3-9,12H,2,10-11,13-16H2,1H3,(H,25,28)