[3-phenylsulfanyl-2-(propan-2-ylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-propan-2-ylcarbamate

Systemtic Name: [3-phenylsulfanyl-2-(propan-2-ylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-propan-2-ylcarbamate Openeye Name: [2-(isopropylcarbamoyloxymethyl)-3-phenylsulfanyl-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-isopropylcarbamate CAS Name: N-propan-2-ylcarbamic acid [2-[[oxo-(propan-2-ylamino)methoxy]methyl]-3-(phenylthio)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl ester IUPAC Name: [3-phenylsulfanyl-2-(propan-2-ylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-propan-2-ylcarbamate Traditional Name: N-isopropylcarbamic acid [2-(isopropylcarbamoyloxymethyl)-3-(phenylthio)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl ester Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)OCC1=C2CCCN2C(=C1COC(=O)NC(C)C)SC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)OCC1=C2CCCN2C(=C1COC(=O)NC(C)C)SC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O4S/c1-15(2)24-22(27)29-13-18-19(14-30-23(28)25-16(3)4)21(26-12-8-11-20(18)26)31-17-9-6-5-7-10-17/h5-7,9-10,15-16H,8,11-14H2,1-4H3,(H,24,27)(H,25,28)