N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-phenethyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-phenethyl-pyrazine-2-carboxamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxo-propyl]-N-phenethyl-pyrazine-2-carboxamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]-3-oxopropyl]-N-phenethyl-2-pyrazinecarboxamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]-N-phenethylpyrazine-2-carboxamide Traditional Name: N-[3-keto-3-[4-(4-methoxyphenyl)piperazino]propyl]-N-phenethyl-pyrazinamide Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCN(CCC3=CC=CC=C3)C(=O)C4=NC=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCN(CCC3=CC=CC=C3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C27H31N5O3/c1-35-24-9-7-23(8-10-24)30-17-19-31(20-18-30)26(33)12-16-32(15-11-22-5-3-2-4-6-22)27(34)25-21-28-13-14-29-25/h2-10,13-14,21H,11-12,15-20H2,1H3