tert-butyl 2-[1-[4,4-bis(3-methylthiophen-2-yl)but-3-enyl]azetidin-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[1-[4,4-bis(3-methylthiophen-2-yl)but-3-enyl]azetidin-2-yl]ethanoate Openeye Name: tert-butyl 2-[1-[4,4-bis(3-methyl-2-thienyl)but-3-enyl]azetidin-2-yl]acetate CAS Name: 2-[1-[4,4-bis(3-methyl-2-thiophenyl)but-3-enyl]-2-azetidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-[4,4-bis(3-methylthiophen-2-yl)but-3-enyl]azetidin-2-yl]acetate Traditional Name: 2-[1-[4,4-bis(3-methyl-2-thienyl)but-3-enyl]azetidin-2-yl]acetic acid tert-butyl ester Formula: C23H31NO2S2 MolecularWeight: 417.62774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=CCCN2CCC2CC(=O)OC(C)(C)C)C3=C(C=CS3)C

Isomeric SMILES

CC1=C(SC=C1)C(=CCCN2CCC2CC(=O)OC(C)(C)C)C3=C(C=CS3)C

InChI

InChI=1S/C23H31NO2S2/c1-16-9-13-27-21(16)19(22-17(2)10-14-28-22)7-6-11-24-12-8-18(24)15-20(25)26-23(3,4)5/h7,9-10,13-14,18H,6,8,11-12,15H2,1-5H3