[1-[1-[2-(3-methylbutylcarbamoyl)phenothiazin-10-yl]propyl]pyrrolidin-2-yl]methyl ethanoate

Systemtic Name: [1-[1-[2-(3-methylbutylcarbamoyl)phenothiazin-10-yl]propyl]pyrrolidin-2-yl]methyl ethanoate Openeye Name: [1-[1-[2-(isopentylcarbamoyl)phenothiazin-10-yl]propyl]pyrrolidin-2-yl]methyl acetate CAS Name: acetic acid [1-[1-[2-[(3-methylbutylamino)-oxomethyl]-10-phenothiazinyl]propyl]-2-pyrrolidinyl]methyl ester IUPAC Name: [1-[1-[2-(3-methylbutylcarbamoyl)phenothiazin-10-yl]propyl]pyrrolidin-2-yl]methyl acetate Traditional Name: acetic acid [1-[1-[2-(isoamylcarbamoyl)phenothiazin-10-yl]propyl]pyrrolidin-2-yl]methyl ester Formula: C28H37N3O3S MolecularWeight: 495.67668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCCC1COC(=O)C)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=O)NCCC(C)C

Isomeric SMILES

CCC(N1CCCC1COC(=O)C)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=O)NCCC(C)C

InChI

InChI=1S/C28H37N3O3S/c1-5-27(30-16-8-9-22(30)18-34-20(4)32)31-23-10-6-7-11-25(23)35-26-13-12-21(17-24(26)31)28(33)29-15-14-19(2)3/h6-7,10-13,17,19,22,27H,5,8-9,14-16,18H2,1-4H3,(H,29,33)