4-[5-(4-carbamimidoylphenoxy)pentoxy]benzenecarboximidamide; 3-(2-chloranylphenothiazin-10-yl)-N,N-dimethyl-propan-1-amine

Systemtic Name: 4-[5-(4-carbamimidoylphenoxy)pentoxy]benzenecarboximidamide; 3-(2-chloranylphenothiazin-10-yl)-N,N-dimethyl-propan-1-amine Openeye Name: 4-[5-(4-carbamimidoylphenoxy)pentoxy]benzamidine; 3-(2-chlorophenothiazin-10-yl)-N,N-dimethyl-propan-1-amine CAS Name: 4-[5-(4-carbamimidoylphenoxy)pentoxy]benzenecarboximidamide; 3-(2-chloro-10-phenothiazinyl)-N,N-dimethyl-1-propanamine IUPAC Name: 4-[5-(4-carbamimidoylphenoxy)pentoxy]benzenecarboximidamide; 3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine Traditional Name: 4-[5-(4-amidinophenoxy)pentoxy]benzamidine; 3-(2-chlorophenothiazin-10-yl)propyl-dimethyl-amine Formula: C36H43ClN6O2S MolecularWeight: 659.28362

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H24N4O2.C17H19ClN2S/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23;1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23);3-4,6-9,12H,5,10-11H2,1-2H3