1-acetamido-1-(3-pyrrol-1-ylphenyl)carbonyl-guanidine; morpholine; dihydrochloride

Systemtic Name: 1-acetamido-1-(3-pyrrol-1-ylphenyl)carbonyl-guanidine; morpholine; dihydrochloride Openeye Name: 1-acetamido-1-(3-pyrrol-1-ylbenzoyl)guanidine; morpholine; dihydrochloride CAS Name: 1-acetamido-1-[oxo-[3-(1-pyrrolyl)phenyl]methyl]guanidine; morpholine; dihydrochloride IUPAC Name: 1-acetamido-1-(3-pyrrol-1-ylbenzoyl)guanidine; morpholine; dihydrochloride Traditional Name: 1-acetamido-1-(3-pyrrol-1-ylbenzoyl)guanidine; morpholine; dihydrochloride Formula: C18H26Cl2N6O3 MolecularWeight: 445.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN(C(=O)C1=CC(=CC=C1)N2C=CC=C2)C(=N)N.C1COCCN1.Cl.Cl

Isomeric SMILES

CC(=O)NN(C(=O)C1=CC(=CC=C1)N2C=CC=C2)C(=N)N.C1COCCN1.Cl.Cl

InChI

InChI=1S/C14H15N5O2.C4H9NO.2ClH/c1-10(20)17-19(14(15)16)13(21)11-5-4-6-12(9-11)18-7-2-3-8-18;1-3-6-4-2-5-1;;/h2-9H,1H3,(H3,15,16)(H,17,20);5H,1-4H2;2*1H