N-(2-methylbutyl)-1-propyl-10-pyrrolidin-1-yl-phenothiazine-2-carboxamide

Systemtic Name: N-(2-methylbutyl)-1-propyl-10-pyrrolidin-1-yl-phenothiazine-2-carboxamide Openeye Name: N-(2-methylbutyl)-1-propyl-10-pyrrolidin-1-yl-phenothiazine-2-carboxamide CAS Name: N-(2-methylbutyl)-1-propyl-10-(1-pyrrolidinyl)-2-phenothiazinecarboxamide IUPAC Name: N-(2-methylbutyl)-1-propyl-10-pyrrolidin-1-ylphenothiazine-2-carboxamide Traditional Name: N-(2-methylbutyl)-1-propyl-10-pyrrolidino-phenothiazine-2-carboxamide Formula: C25H33N3OS MolecularWeight: 423.61402

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1N(C3=CC=CC=C3S2)N4CCCC4)C(=O)NCC(C)CC

Isomeric SMILES

CCCC1=C(C=CC2=C1N(C3=CC=CC=C3S2)N4CCCC4)C(=O)NCC(C)CC

InChI

InChI=1S/C25H33N3OS/c1-4-10-19-20(25(29)26-17-18(3)5-2)13-14-23-24(19)28(27-15-8-9-16-27)21-11-6-7-12-22(21)30-23/h6-7,11-14,18H,4-5,8-10,15-17H2,1-3H3,(H,26,29)