10-[1-[2-(hydroxymethyl)pyrrolidin-2-yl]propyl]-N-(3-methylbutyl)phenothiazine-2-carboxamide

Systemtic Name: 10-[1-[2-(hydroxymethyl)pyrrolidin-2-yl]propyl]-N-(3-methylbutyl)phenothiazine-2-carboxamide Openeye Name: 10-[1-[2-(hydroxymethyl)pyrrolidin-2-yl]propyl]-N-isopentyl-phenothiazine-2-carboxamide CAS Name: 10-[1-[2-(hydroxymethyl)-2-pyrrolidinyl]propyl]-N-(3-methylbutyl)-2-phenothiazinecarboxamide IUPAC Name: 10-[1-[2-(hydroxymethyl)pyrrolidin-2-yl]propyl]-N-(3-methylbutyl)phenothiazine-2-carboxamide Traditional Name: N-isoamyl-10-[1-(2-methylolpyrrolidin-2-yl)propyl]phenothiazine-2-carboxamide Formula: C26H35N3O2S MolecularWeight: 453.64

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1(CCCN1)CO)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=O)NCCC(C)C

Isomeric SMILES

CCC(C1(CCCN1)CO)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=O)NCCC(C)C

InChI

InChI=1S/C26H35N3O2S/c1-4-24(26(17-30)13-7-14-28-26)29-20-8-5-6-9-22(20)32-23-11-10-19(16-21(23)29)25(31)27-15-12-18(2)3/h5-6,8-11,16,18,24,28,30H,4,7,12-15,17H2,1-3H3,(H,27,31)