1-[4-[2-azanyl-3-(2-cyanopyrrolidin-1-yl)-3-oxidanylidene-propyl]phenyl]-1-cyano-2-methyl-guanidine

Systemtic Name: 1-[4-[2-azanyl-3-(2-cyanopyrrolidin-1-yl)-3-oxidanylidene-propyl]phenyl]-1-cyano-2-methyl-guanidine Openeye Name: 1-[4-[2-amino-3-(2-cyanopyrrolidin-1-yl)-3-oxo-propyl]phenyl]-1-cyano-2-methyl-guanidine CAS Name: 1-[4-[2-amino-3-(2-cyano-1-pyrrolidinyl)-3-oxopropyl]phenyl]-1-cyano-2-methylguanidine IUPAC Name: 1-[4-[2-amino-3-(2-cyanopyrrolidin-1-yl)-3-oxopropyl]phenyl]-1-cyano-2-methylguanidine Traditional Name: 1-[4-[2-amino-3-(2-cyanopyrrolidino)-3-keto-propyl]phenyl]-1-cyano-2-methyl-guanidine Formula: C17H21N7O MolecularWeight: 339.39494

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(C#N)C1=CC=C(C=C1)CC(C(=O)N2CCCC2C#N)N

Isomeric SMILES

CN=C(N)N(C#N)C1=CC=C(C=C1)CC(C(=O)N2CCCC2C#N)N

InChI

InChI=1S/C17H21N7O/c1-22-17(21)24(11-19)13-6-4-12(5-7-13)9-15(20)16(25)23-8-2-3-14(23)10-18/h4-7,14-15H,2-3,8-9,20H2,1H3,(H2,21,22)