1-[3-[2-[3-(phenylcarbonyl)phenyl]propan-2-yl]-1,2-oxazol-5-yl]-2-(2-pyrrolidin-1-ylethyl)guanidine

Systemtic Name: 1-[3-[2-[3-(phenylcarbonyl)phenyl]propan-2-yl]-1,2-oxazol-5-yl]-2-(2-pyrrolidin-1-ylethyl)guanidine Openeye Name: 1-[3-[1-(3-benzoylphenyl)-1-methyl-ethyl]isoxazol-5-yl]-2-(2-pyrrolidin-1-ylethyl)guanidine CAS Name: 1-[3-[2-(3-benzoylphenyl)propan-2-yl]-5-isoxazolyl]-2-[2-(1-pyrrolidinyl)ethyl]guanidine IUPAC Name: 1-[3-[2-(3-benzoylphenyl)propan-2-yl]-1,2-oxazol-5-yl]-2-(2-pyrrolidin-1-ylethyl)guanidine Traditional Name: 1-[3-[1-(3-benzoylphenyl)-1-methyl-ethyl]isoxazol-5-yl]-2-(2-pyrrolidinoethyl)guanidine Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C3=NOC(=C3)NC(=NCCN4CCCC4)N

Isomeric SMILES

CC(C)(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C3=NOC(=C3)NC(=NCCN4CCCC4)N

InChI

InChI=1S/C26H31N5O2/c1-26(2,21-12-8-11-20(17-21)24(32)19-9-4-3-5-10-19)22-18-23(33-30-22)29-25(27)28-13-16-31-14-6-7-15-31/h3-5,8-12,17-18H,6-7,13-16H2,1-2H3,(H3,27,28,29)