N-[[4-[[bis(pyridin-2-ylmethyl)amino]methyl]phenyl]methyl]-6-phenothiazin-10-yl-hexanamide

Systemtic Name: N-[[4-[[bis(pyridin-2-ylmethyl)amino]methyl]phenyl]methyl]-6-phenothiazin-10-yl-hexanamide Openeye Name: N-[[4-[[bis(2-pyridylmethyl)amino]methyl]phenyl]methyl]-6-phenothiazin-10-yl-hexanamide CAS Name: N-[[4-[[bis(2-pyridinylmethyl)amino]methyl]phenyl]methyl]-6-(10-phenothiazinyl)hexanamide IUPAC Name: N-[[4-[[bis(pyridin-2-ylmethyl)amino]methyl]phenyl]methyl]-6-phenothiazin-10-ylhexanamide Traditional Name: N-[4-[[bis(2-pyridylmethyl)amino]methyl]benzyl]-6-phenothiazin-10-yl-hexanamide Formula: C38H39N5OS MolecularWeight: 613.81416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCCCCC(=O)NCC4=CC=C(C=C4)CN(CC5=CC=CC=N5)CC6=CC=CC=N6

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCCCCC(=O)NCC4=CC=C(C=C4)CN(CC5=CC=CC=N5)CC6=CC=CC=N6

InChI

InChI=1S/C38H39N5OS/c44-38(18-2-1-11-25-43-34-14-3-5-16-36(34)45-37-17-6-4-15-35(37)43)41-26-30-19-21-31(22-20-30)27-42(28-32-12-7-9-23-39-32)29-33-13-8-10-24-40-33/h3-10,12-17,19-24H,1-2,11,18,25-29H2,(H,41,44)