2-chloranyl-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazine

Systemtic Name: 2-chloranyl-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazine Openeye Name: 2-chloro-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazine CAS Name: 2-chloro-10-[3-(4-methyl-1-piperazin-4-iumyl)propyl]phenothiazine IUPAC Name: 2-chloro-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazine Traditional Name: 2-chloro-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazine Formula: C20H25ClN3S+ MolecularWeight: 374.9506

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C20H24ClN3S/c1-22-11-13-23(14-12-22)9-4-10-24-17-5-2-3-6-19(17)25-20-8-7-16(21)15-18(20)24/h2-3,5-8,15H,4,9-14H2,1H3/p+1