3-methylbutyl 2-(3-oxidanylidene-1-phenothiazin-10-ylcarbonyl-piperazin-2-yl)ethanoate

Systemtic Name: 3-methylbutyl 2-(3-oxidanylidene-1-phenothiazin-10-ylcarbonyl-piperazin-2-yl)ethanoate Openeye Name: isopentyl 2-[3-oxo-1-(phenothiazine-10-carbonyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo(10-phenothiazinyl)methyl]-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[3-oxo-1-(phenothiazine-10-carbonyl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(phenothiazine-10-carbonyl)piperazin-2-yl]acetic acid isoamyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C24H27N3O4S/c1-16(2)11-14-31-22(28)15-19-23(29)25-12-13-26(19)24(30)27-17-7-3-5-9-20(17)32-21-10-6-4-8-18(21)27/h3-10,16,19H,11-15H2,1-2H3,(H,25,29)