N,N-diethyl-10-(8-phenethyl-8-azabicyclo[3.2.1]octan-3-yl)phenothiazine-3-carboximidamide

Systemtic Name: N,N-diethyl-10-(8-phenethyl-8-azabicyclo[3.2.1]octan-3-yl)phenothiazine-3-carboximidamide Openeye Name: N,N-diethyl-10-(8-phenethyl-8-azabicyclo[3.2.1]octan-3-yl)phenothiazine-3-carboxamidine CAS Name: N,N-diethyl-10-(8-phenethyl-8-azabicyclo[3.2.1]octan-3-yl)-3-phenothiazinecarboximidamide IUPAC Name: N,N-diethyl-10-(8-phenethyl-8-azabicyclo[3.2.1]octan-3-yl)phenothiazine-3-carboximidamide Traditional Name: N,N-diethyl-10-(8-phenethyl-8-azabicyclo[3.2.1]octan-3-yl)phenothiazine-3-carboxamidine Formula: C32H38N4S MolecularWeight: 510.73592

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=N)C1=CC2=C(C=C1)N(C3=CC=CC=C3S2)C4CC5CCC(C4)N5CCC6=CC=CC=C6

Isomeric SMILES

CCN(CC)C(=N)C1=CC2=C(C=C1)N(C3=CC=CC=C3S2)C4CC5CCC(C4)N5CCC6=CC=CC=C6

InChI

InChI=1S/C32H38N4S/c1-3-34(4-2)32(33)24-14-17-29-31(20-24)37-30-13-9-8-12-28(30)36(29)27-21-25-15-16-26(22-27)35(25)19-18-23-10-6-5-7-11-23/h5-14,17,20,25-27,33H,3-4,15-16,18-19,21-22H2,1-2H3