tert-butyl 4-acetamido-5-oxidanylidene-5-[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decan-3-yl]pentanoate

Systemtic Name: tert-butyl 4-acetamido-5-oxidanylidene-5-[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decan-3-yl]pentanoate Openeye Name: tert-butyl 4-acetamido-5-oxo-5-[8-[3-(3-thienyl)prop-2-enoyl]-3,8-diazaspiro[4.5]decan-3-yl]pentanoate CAS Name: 4-acetamido-5-oxo-5-[8-[1-oxo-3-(3-thiophenyl)prop-2-enyl]-3,8-diazaspiro[4.5]decan-3-yl]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-acetamido-5-oxo-5-[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decan-3-yl]pentanoate Traditional Name: 4-acetamido-5-keto-5-[8-[3-(3-thienyl)acryloyl]-3,8-diazaspiro[4.5]decan-3-yl]valeric acid tert-butyl ester Formula: C26H37N3O5S MolecularWeight: 503.65408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)OC(C)(C)C)C(=O)N1CCC2(C1)CCN(CC2)C(=O)C=CC3=CSC=C3

Isomeric SMILES

CC(=O)NC(CCC(=O)OC(C)(C)C)C(=O)N1CCC2(C1)CCN(CC2)C(=O)C=CC3=CSC=C3

InChI

InChI=1S/C26H37N3O5S/c1-19(30)27-21(6-8-23(32)34-25(2,3)4)24(33)29-15-12-26(18-29)10-13-28(14-11-26)22(31)7-5-20-9-16-35-17-20/h5,7,9,16-17,21H,6,8,10-15,18H2,1-4H3,(H,27,30)