(3-propan-2-ylphenyl) 4-(2-dimethylaminoethyloxy)-2-methyl-5-[(2-methyl-2-nitrososulfanyl-propyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: (3-propan-2-ylphenyl) 4-(2-dimethylaminoethyloxy)-2-methyl-5-[(2-methyl-2-nitrososulfanyl-propyl)amino]-5-oxidanylidene-pentanoate Openeye Name: (3-isopropylphenyl) 4-(2-dimethylaminoethyloxy)-2-methyl-5-[(2-methyl-2-nitrososulfanyl-propyl)amino]-5-oxo-pentanoate CAS Name: 4-(2-dimethylaminoethyloxy)-2-methyl-5-[[2-methyl-2-(nitrosothio)propyl]amino]-5-oxopentanoic acid (3-propan-2-ylphenyl) ester IUPAC Name: (3-propan-2-ylphenyl) 4-(2-dimethylaminoethyloxy)-2-methyl-5-[(2-methyl-2-nitrososulfanylpropyl)amino]-5-oxopentanoate Traditional Name: 4-(2-dimethylaminoethyloxy)-5-keto-2-methyl-5-[[2-methyl-2-(nitrosothio)propyl]amino]valeric acid m-cumenyl ester Formula: C23H37N3O5S MolecularWeight: 467.62198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OC(=O)C(C)CC(C(=O)NCC(C)(C)SN=O)OCCN(C)C

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OC(=O)C(C)CC(C(=O)NCC(C)(C)SN=O)OCCN(C)C

InChI

InChI=1S/C23H37N3O5S/c1-16(2)18-9-8-10-19(14-18)31-22(28)17(3)13-20(30-12-11-26(6)7)21(27)24-15-23(4,5)32-25-29/h8-10,14,16-17,20H,11-13,15H2,1-7H3,(H,24,27)