N-(4-morpholin-4-ylbutyl)-3-[6-[[(1S)-1-phenylethyl]amino]pyrazin-2-yl]benzimidazole-5-carboxamide

Systemtic Name: N-(4-morpholin-4-ylbutyl)-3-[6-[[(1S)-1-phenylethyl]amino]pyrazin-2-yl]benzimidazole-5-carboxamide Openeye Name: N-(4-morpholinobutyl)-3-[6-[[(1S)-1-phenylethyl]amino]pyrazin-2-yl]benzimidazole-5-carboxamide CAS Name: N-[4-(4-morpholinyl)butyl]-3-[6-[[(1S)-1-phenylethyl]amino]-2-pyrazinyl]-5-benzimidazolecarboxamide IUPAC Name: N-(4-morpholin-4-ylbutyl)-3-[6-[[(1S)-1-phenylethyl]amino]pyrazin-2-yl]benzimidazole-5-carboxamide Traditional Name: N-(4-morpholinobutyl)-3-[6-[[(1S)-1-phenylethyl]amino]pyrazin-2-yl]benzimidazole-5-carboxamide Formula: C28H33N7O2 MolecularWeight: 499.60732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC(=CN=C2)N3C=NC4=C3C=C(C=C4)C(=O)NCCCCN5CCOCC5

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC2=NC(=CN=C2)N3C=NC4=C3C=C(C=C4)C(=O)NCCCCN5CCOCC5

InChI

InChI=1S/C28H33N7O2/c1-21(22-7-3-2-4-8-22)32-26-18-29-19-27(33-26)35-20-31-24-10-9-23(17-25(24)35)28(36)30-11-5-6-12-34-13-15-37-16-14-34/h2-4,7-10,17-21H,5-6,11-16H2,1H3,(H,30,36)(H,32,33)/t21-/m0/s1