10-[3-[4-(2-adamantyl)piperazin-1-yl]propyl]-2-chloranyl-phenothiazine

Systemtic Name: 10-[3-[4-(2-adamantyl)piperazin-1-yl]propyl]-2-chloranyl-phenothiazine Openeye Name: 10-[3-[4-(2-adamantyl)piperazin-1-yl]propyl]-2-chloro-phenothiazine CAS Name: 10-[3-[4-(2-adamantyl)-1-piperazinyl]propyl]-2-chlorophenothiazine IUPAC Name: 10-[3-[4-(2-adamantyl)piperazin-1-yl]propyl]-2-chlorophenothiazine Traditional Name: 10-[3-[4-(2-adamantyl)piperazino]propyl]-2-chloro-phenothiazine Formula: C29H36ClN3S MolecularWeight: 494.13424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)C5C6CC7CC(C6)CC5C7

Isomeric SMILES

C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)C5C6CC7CC(C6)CC5C7

InChI

InChI=1S/C29H36ClN3S/c30-24-6-7-28-26(19-24)33(25-4-1-2-5-27(25)34-28)9-3-8-31-10-12-32(13-11-31)29-22-15-20-14-21(17-22)18-23(29)16-20/h1-2,4-7,19-23,29H,3,8-18H2