N-[N'-(3-phenylbutyl)carbamimidoyl]-3-[1-(triphenylmethyl)imidazol-4-yl]propanamide

Systemtic Name: N-[N'-(3-phenylbutyl)carbamimidoyl]-3-[1-(triphenylmethyl)imidazol-4-yl]propanamide Openeye Name: N-[N'-(3-phenylbutyl)carbamimidoyl]-3-(1-tritylimidazol-4-yl)propanamide CAS Name: N-[amino(3-phenylbutylimino)methyl]-3-[1-(triphenylmethyl)-4-imidazolyl]propanamide IUPAC Name: N-[N'-(3-phenylbutyl)carbamimidoyl]-3-(1-tritylimidazol-4-yl)propanamide Traditional Name: N-[N'-(3-phenylbutyl)amidino]-3-(1-tritylimidazol-4-yl)propionamide Formula: C36H37N5O MolecularWeight: 555.71188

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN=C(N)NC(=O)CCC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(CCN=C(N)NC(=O)CCC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C36H37N5O/c1-28(29-14-6-2-7-15-29)24-25-38-35(37)40-34(42)23-22-33-26-41(27-39-33)36(30-16-8-3-9-17-30,31-18-10-4-11-19-31)32-20-12-5-13-21-32/h2-21,26-28H,22-25H2,1H3,(H3,37,38,40,42)