S-[2-[[1-(3-methylbutyl)cyclopentyl]carbonylamino]phenyl] 2-methoxybenzenecarbothioate

Systemtic Name: S-[2-[[1-(3-methylbutyl)cyclopentyl]carbonylamino]phenyl] 2-methoxybenzenecarbothioate Openeye Name: S-[2-[(1-isopentylcyclopentanecarbonyl)amino]phenyl] 2-methoxybenzenecarbothioate CAS Name: 2-methoxybenzenecarbothioic acid S-[2-[[[1-(3-methylbutyl)cyclopentyl]-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[[1-(3-methylbutyl)cyclopentanecarbonyl]amino]phenyl] 2-methoxybenzenecarbothioate Traditional Name: 2-methoxythiobenzoic acid S-[2-[(1-isoamylcyclopentanecarbonyl)amino]phenyl] ester Formula: C25H31NO3S MolecularWeight: 425.58354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CCCC1)C(=O)NC2=CC=CC=C2SC(=O)C3=CC=CC=C3OC

Isomeric SMILES

CC(C)CCC1(CCCC1)C(=O)NC2=CC=CC=C2SC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C25H31NO3S/c1-18(2)14-17-25(15-8-9-16-25)24(28)26-20-11-5-7-13-22(20)30-23(27)19-10-4-6-12-21(19)29-3/h4-7,10-13,18H,8-9,14-17H2,1-3H3,(H,26,28)