N-[(3-chlorophenyl)methyl]-1-propyl-10-pyrrolidin-1-yl-phenothiazine-2-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-1-propyl-10-pyrrolidin-1-yl-phenothiazine-2-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-1-propyl-10-pyrrolidin-1-yl-phenothiazine-2-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-1-propyl-10-(1-pyrrolidinyl)-2-phenothiazinecarboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-1-propyl-10-pyrrolidin-1-ylphenothiazine-2-carboxamide Traditional Name: N-(3-chlorobenzyl)-1-propyl-10-pyrrolidino-phenothiazine-2-carboxamide Formula: C27H28ClN3OS MolecularWeight: 478.04872

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1N(C3=CC=CC=C3S2)N4CCCC4)C(=O)NCC5=CC(=CC=C5)Cl

Isomeric SMILES

CCCC1=C(C=CC2=C1N(C3=CC=CC=C3S2)N4CCCC4)C(=O)NCC5=CC(=CC=C5)Cl

InChI

InChI=1S/C27H28ClN3OS/c1-2-8-21-22(27(32)29-18-19-9-7-10-20(28)17-19)13-14-25-26(21)31(30-15-5-6-16-30)23-11-3-4-12-24(23)33-25/h3-4,7,9-14,17H,2,5-6,8,15-16,18H2,1H3,(H,29,32)