2-[2-(5-tert-butyl-1-phenethyl-4-phenyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]guanidine

Systemtic Name: 2-[2-(5-tert-butyl-1-phenethyl-4-phenyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]guanidine Openeye Name: 2-[2-(5-tert-butyl-1-phenethyl-4-phenyl-pyrrol-3-yl)-2-oxo-ethyl]guanidine CAS Name: 2-[2-(5-tert-butyl-1-phenethyl-4-phenyl-3-pyrrolyl)-2-oxoethyl]guanidine IUPAC Name: 2-[2-(5-tert-butyl-1-phenethyl-4-phenylpyrrol-3-yl)-2-oxoethyl]guanidine Traditional Name: 2-[2-(5-tert-butyl-1-phenethyl-4-phenyl-pyrrol-3-yl)-2-keto-ethyl]guanidine Formula: C25H30N4O MolecularWeight: 402.5319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CN1CCC2=CC=CC=C2)C(=O)CN=C(N)N)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=C(C(=CN1CCC2=CC=CC=C2)C(=O)CN=C(N)N)C3=CC=CC=C3

InChI

InChI=1S/C25H30N4O/c1-25(2,3)23-22(19-12-8-5-9-13-19)20(21(30)16-28-24(26)27)17-29(23)15-14-18-10-6-4-7-11-18/h4-13,17H,14-16H2,1-3H3,(H4,26,27,28)