S-[2-[[1-(2,3-dihydro-1H-inden-2-yl)aziridin-2-yl]carbonylamino]ethyl] benzenecarbothioate

Systemtic Name: S-[2-[[1-(2,3-dihydro-1H-inden-2-yl)aziridin-2-yl]carbonylamino]ethyl] benzenecarbothioate Openeye Name: S-[2-[(1-indan-2-ylaziridine-2-carbonyl)amino]ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[[[1-(2,3-dihydro-1H-inden-2-yl)-2-aziridinyl]-oxomethyl]amino]ethyl] ester IUPAC Name: S-[2-[[1-(2,3-dihydro-1H-inden-2-yl)aziridine-2-carbonyl]amino]ethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[(1-indan-2-ylethylenimine-2-carbonyl)amino]ethyl] ester Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=CC=CC=C21)N3CC3C(=O)NCCSC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(CC2=CC=CC=C21)N3CC3C(=O)NCCSC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O2S/c24-20(22-10-11-26-21(25)15-6-2-1-3-7-15)19-14-23(19)18-12-16-8-4-5-9-17(16)13-18/h1-9,18-19H,10-14H2,(H,22,24)