N-(2-ethylbutyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carboxamide

Systemtic Name: N-(2-ethylbutyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carboxamide Openeye Name: N-(2-ethylbutyl)-10-(1-methyl-2-pyrrolidin-1-yl-ethyl)phenothiazine-2-carboxamide CAS Name: N-(2-ethylbutyl)-10-[1-(1-pyrrolidinyl)propan-2-yl]-2-phenothiazinecarboxamide IUPAC Name: N-(2-ethylbutyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carboxamide Traditional Name: N-(2-ethylbutyl)-10-(1-methyl-2-pyrrolidino-ethyl)phenothiazine-2-carboxamide Formula: C26H35N3OS MolecularWeight: 437.6406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2C(C)CN4CCCC4

Isomeric SMILES

CCC(CC)CNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2C(C)CN4CCCC4

InChI

InChI=1S/C26H35N3OS/c1-4-20(5-2)17-27-26(30)21-12-13-25-23(16-21)29(19(3)18-28-14-8-9-15-28)22-10-6-7-11-24(22)31-25/h6-7,10-13,16,19-20H,4-5,8-9,14-15,17-18H2,1-3H3,(H,27,30)