6-chloranyl-2-methoxy-N-[4-[4-(3-phenothiazin-10-ylpropyl)piperazin-1-yl]butyl]acridin-9-amine

Systemtic Name: 6-chloranyl-2-methoxy-N-[4-[4-(3-phenothiazin-10-ylpropyl)piperazin-1-yl]butyl]acridin-9-amine Openeye Name: 6-chloro-2-methoxy-N-[4-[4-(3-phenothiazin-10-ylpropyl)piperazin-1-yl]butyl]acridin-9-amine CAS Name: 6-chloro-2-methoxy-N-[4-[4-[3-(10-phenothiazinyl)propyl]-1-piperazinyl]butyl]-9-acridinamine IUPAC Name: 6-chloro-2-methoxy-N-[4-[4-(3-phenothiazin-10-ylpropyl)piperazin-1-yl]butyl]acridin-9-amine Traditional Name: (6-chloro-2-methoxy-acridin-9-yl)-[4-[4-(3-phenothiazin-10-ylpropyl)piperazino]butyl]amine Formula: C37H40ClN5OS MolecularWeight: 638.2644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCCN4CCN(CC4)CCCN5C6=CC=CC=C6SC7=CC=CC=C75

Isomeric SMILES

COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCCN4CCN(CC4)CCCN5C6=CC=CC=C6SC7=CC=CC=C75

InChI

InChI=1S/C37H40ClN5OS/c1-44-28-14-16-31-30(26-28)37(29-15-13-27(38)25-32(29)40-31)39-17-6-7-18-41-21-23-42(24-22-41)19-8-20-43-33-9-2-4-11-35(33)45-36-12-5-3-10-34(36)43/h2-5,9-16,25-26H,6-8,17-24H2,1H3,(H,39,40)