N-[2-methyl-4-[1-[3-methyl-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]cyclohexyl]phenyl]-3-phenothiazin-10-yl-propanamide

Systemtic Name: N-[2-methyl-4-[1-[3-methyl-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]cyclohexyl]phenyl]-3-phenothiazin-10-yl-propanamide Openeye Name: N-[2-methyl-4-[1-[3-methyl-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]cyclohexyl]phenyl]-3-phenothiazin-10-yl-propanamide CAS Name: N-[2-methyl-4-[1-[3-methyl-4-[[1-oxo-3-(10-phenothiazinyl)propyl]amino]phenyl]cyclohexyl]phenyl]-3-(10-phenothiazinyl)propanamide IUPAC Name: N-[2-methyl-4-[1-[3-methyl-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]cyclohexyl]phenyl]-3-phenothiazin-10-ylpropanamide Traditional Name: N-[2-methyl-4-[1-[3-methyl-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]cyclohexyl]phenyl]-3-phenothiazin-10-yl-propionamide Formula: C50H48N4O2S2 MolecularWeight: 801.07172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(CCCCC2)C3=CC(=C(C=C3)NC(=O)CCN4C5=CC=CC=C5SC6=CC=CC=C64)C)NC(=O)CCN7C8=CC=CC=C8SC9=CC=CC=C97

Isomeric SMILES

CC1=C(C=CC(=C1)C2(CCCCC2)C3=CC(=C(C=C3)NC(=O)CCN4C5=CC=CC=C5SC6=CC=CC=C64)C)NC(=O)CCN7C8=CC=CC=C8SC9=CC=CC=C97

InChI

InChI=1S/C50H48N4O2S2/c1-34-32-36(22-24-38(34)51-48(55)26-30-53-40-14-4-8-18-44(40)57-45-19-9-5-15-41(45)53)50(28-12-3-13-29-50)37-23-25-39(35(2)33-37)52-49(56)27-31-54-42-16-6-10-20-46(42)58-47-21-11-7-17-43(47)54/h4-11,14-25,32-33H,3,12-13,26-31H2,1-2H3,(H,51,55)(H,52,56)