2-[3-[bis(phenylmethyl)amino]propylamino]-1-phenothiazin-10-yl-ethanone

Systemtic Name: 2-[3-[bis(phenylmethyl)amino]propylamino]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[3-(dibenzylamino)propylamino]-1-phenothiazin-10-yl-ethanone CAS Name: 2-[3-[bis(phenylmethyl)amino]propylamino]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[3-(dibenzylamino)propylamino]-1-phenothiazin-10-ylethanone Traditional Name: 2-[3-(dibenzylamino)propylamino]-1-phenothiazin-10-yl-ethanone Formula: C31H31N3OS MolecularWeight: 493.66234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCNCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCNCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)CC5=CC=CC=C5

InChI

InChI=1S/C31H31N3OS/c35-31(34-27-16-7-9-18-29(27)36-30-19-10-8-17-28(30)34)22-32-20-11-21-33(23-25-12-3-1-4-13-25)24-26-14-5-2-6-15-26/h1-10,12-19,32H,11,20-24H2