2-[4-[3-(2-chloranylphenothiazin-10-yl)propyl]piperazin-1-yl]ethyl furan-2-carboxylate

Systemtic Name: 2-[4-[3-(2-chloranylphenothiazin-10-yl)propyl]piperazin-1-yl]ethyl furan-2-carboxylate Openeye Name: 2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethyl furan-2-carboxylate CAS Name: 2-furancarboxylic acid 2-[4-[3-(2-chloro-10-phenothiazinyl)propyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethyl furan-2-carboxylate Traditional Name: furan-2-carboxylic acid 2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazino]ethyl ester Formula: C26H28ClN3O3S MolecularWeight: 498.03682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCOC(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCOC(=O)C5=CC=CO5

InChI

InChI=1S/C26H28ClN3O3S/c27-20-8-9-25-22(19-20)30(21-5-1-2-7-24(21)34-25)11-4-10-28-12-14-29(15-13-28)16-18-33-26(31)23-6-3-17-32-23/h1-3,5-9,17,19H,4,10-16,18H2