1-(3-chloranylphenoxy)-1-[4-oxidanylidene-4-(4-pyridin-4-ylpiperazin-1-yl)butoxy]guanidine

Systemtic Name: 1-(3-chloranylphenoxy)-1-[4-oxidanylidene-4-(4-pyridin-4-ylpiperazin-1-yl)butoxy]guanidine Openeye Name: 1-(3-chlorophenoxy)-1-[4-oxo-4-[4-(4-pyridyl)piperazin-1-yl]butoxy]guanidine CAS Name: 1-(3-chlorophenoxy)-1-[4-oxo-4-(4-pyridin-4-yl-1-piperazinyl)butoxy]guanidine IUPAC Name: 1-(3-chlorophenoxy)-1-[4-oxo-4-(4-pyridin-4-ylpiperazin-1-yl)butoxy]guanidine Traditional Name: 1-(3-chlorophenoxy)-1-[4-keto-4-[4-(4-pyridyl)piperazino]butoxy]guanidine Formula: C20H25ClN6O3 MolecularWeight: 432.9039

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=O)CCCON(C(=N)N)OC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=O)CCCON(C(=N)N)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H25ClN6O3/c21-16-3-1-4-18(15-16)30-27(20(22)23)29-14-2-5-19(28)26-12-10-25(11-13-26)17-6-8-24-9-7-17/h1,3-4,6-9,15H,2,5,10-14H2,(H3,22,23)