N-[4-(4-tert-butylphenyl)-4-oxidanylidene-3-[1-(2-phenylethanoyl)pyrrolidin-3-yl]butyl]pyrazine-2-carboxamide

Systemtic Name: N-[4-(4-tert-butylphenyl)-4-oxidanylidene-3-[1-(2-phenylethanoyl)pyrrolidin-3-yl]butyl]pyrazine-2-carboxamide Openeye Name: N-[4-(4-tert-butylphenyl)-4-oxo-3-[1-(2-phenylacetyl)pyrrolidin-3-yl]butyl]pyrazine-2-carboxamide CAS Name: N-[4-(4-tert-butylphenyl)-4-oxo-3-[1-(1-oxo-2-phenylethyl)-3-pyrrolidinyl]butyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-(4-tert-butylphenyl)-4-oxo-3-[1-(2-phenylacetyl)pyrrolidin-3-yl]butyl]pyrazine-2-carboxamide Traditional Name: N-[4-(4-tert-butylphenyl)-4-keto-3-[1-(2-phenylacetyl)pyrrolidin-3-yl]butyl]pyrazinamide Formula: C31H36N4O3 MolecularWeight: 512.64254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C(CCNC(=O)C2=NC=CN=C2)C3CCN(C3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C(CCNC(=O)C2=NC=CN=C2)C3CCN(C3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C31H36N4O3/c1-31(2,3)25-11-9-23(10-12-25)29(37)26(13-15-34-30(38)27-20-32-16-17-33-27)24-14-18-35(21-24)28(36)19-22-7-5-4-6-8-22/h4-12,16-17,20,24,26H,13-15,18-19,21H2,1-3H3,(H,34,38)