S-[2-[[1-[(2-methoxyphenyl)methyl]aziridin-2-yl]carbonylamino]ethyl] benzenecarbothioate

Systemtic Name: S-[2-[[1-[(2-methoxyphenyl)methyl]aziridin-2-yl]carbonylamino]ethyl] benzenecarbothioate Openeye Name: S-[2-[[1-[(2-methoxyphenyl)methyl]aziridine-2-carbonyl]amino]ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[[[1-[(2-methoxyphenyl)methyl]-2-aziridinyl]-oxomethyl]amino]ethyl] ester IUPAC Name: S-[2-[[1-[(2-methoxyphenyl)methyl]aziridine-2-carbonyl]amino]ethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[(1-o-anisylethylenimine-2-carbonyl)amino]ethyl] ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2CC2C(=O)NCCSC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1CN2CC2C(=O)NCCSC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S/c1-25-18-10-6-5-9-16(18)13-22-14-17(22)19(23)21-11-12-26-20(24)15-7-3-2-4-8-15/h2-10,17H,11-14H2,1H3,(H,21,23)