1-phenethyl-4-[[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]pyrrolidin-2-one

Systemtic Name: 1-phenethyl-4-[[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]pyrrolidin-2-one Openeye Name: 1-phenethyl-4-[8-[3-(3-thienyl)prop-2-enoyl]-3,8-diazaspiro[4.5]decane-3-carbonyl]pyrrolidin-2-one CAS Name: 4-[oxo-[8-[1-oxo-3-(3-thiophenyl)prop-2-enyl]-3,8-diazaspiro[4.5]decan-3-yl]methyl]-1-phenethyl-2-pyrrolidinone IUPAC Name: 1-phenethyl-4-[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]pyrrolidin-2-one Traditional Name: 1-phenethyl-4-[8-[3-(3-thienyl)acryloyl]-3,8-diazaspiro[4.5]decane-3-carbonyl]-2-pyrrolidone Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CCN(C2)C(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4)C(=O)C=CC5=CSC=C5

Isomeric SMILES

C1CN(CCC12CCN(C2)C(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4)C(=O)C=CC5=CSC=C5

InChI

InChI=1S/C28H33N3O3S/c32-25(7-6-23-9-17-35-20-23)29-14-10-28(11-15-29)12-16-31(21-28)27(34)24-18-26(33)30(19-24)13-8-22-4-2-1-3-5-22/h1-7,9,17,20,24H,8,10-16,18-19,21H2