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2-[4-(4-methylphenyl)sulfonyl-7-oxidanylidene-1,4-diazepan-1-yl]ethyl N-(3,4-dimethylphenyl)carbamate

2-[4-(4-methylphenyl)sulfonyl-7-oxidanylidene-1,4-diazepan-1-yl]ethyl N-(3,4-dimethylphenyl)carbamate

Systemtic Name:2-[4-(4-methylphenyl)sulfonyl-7-oxidanylidene-1,4-diazepan-1-yl]ethyl N-(3,4-dimethylphenyl)carbamate
Openeye Name:2-[7-oxo-4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]ethyl N-(3,4-dimethylphenyl)carbamate
CAS Name:N-(3,4-dimethylphenyl)carbamic acid 2-[4-(4-methylphenyl)sulfonyl-7-oxo-1,4-diazepan-1-yl]ethyl ester
IUPAC Name:2-[4-(4-methylphenyl)sulfonyl-7-oxo-1,4-diazepan-1-yl]ethyl N-(3,4-dimethylphenyl)carbamate
Traditional Name:N-(3,4-dimethylphenyl)carbamic acid 2-(7-keto-4-tosyl-1,4-diazepan-1-yl)ethyl ester
Formula: C23H29N3O5S
MolecularWeight: 459.55846
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)N(CC2)CCOC(=O)NC3=CC(=C(C=C3)C)C


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)N(CC2)CCOC(=O)NC3=CC(=C(C=C3)C)C


InChI

InChI=1S/C23H29N3O5S/c1-17-4-8-21(9-5-17)32(29,30)26-11-10-22(27)25(12-13-26)14-15-31-23(28)24-20-7-6-18(2)19(3)16-20/h4-9,16H,10-15H2,1-3H3,(H,24,28)


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