N-(2-azanylethyl)-5-[3-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]propylamino]pyrazine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-5-[3-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]propylamino]pyrazine-2-carboxamide Openeye Name: N-(2-aminoethyl)-5-[3-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]propylamino]pyrazine-2-carboxamide CAS Name: N-(2-aminoethyl)-5-[3-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]propylamino]-2-pyrazinecarboxamide IUPAC Name: N-(2-aminoethyl)-5-[3-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]propylamino]pyrazine-2-carboxamide Traditional Name: N-(2-aminoethyl)-5-[3-[4-(5-chloro-2-methoxy-phenyl)piperazino]propylamino]pyrazinamide Formula: C21H30ClN7O2 MolecularWeight: 447.9616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCCNC3=NC=C(N=C3)C(=O)NCCN

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCCNC3=NC=C(N=C3)C(=O)NCCN

InChI

InChI=1S/C21H30ClN7O2/c1-31-19-4-3-16(22)13-18(19)29-11-9-28(10-12-29)8-2-6-24-20-15-26-17(14-27-20)21(30)25-7-5-23/h3-4,13-15H,2,5-12,23H2,1H3,(H,24,27)(H,25,30)