1-cyano-2-[1-[2-(furan-3-yl)-2-oxidanylidene-ethyl]-2-oxidanylidene-azepan-3-yl]-3-(2-methyl-1-benzofuran-5-yl)guanidine

Systemtic Name: 1-cyano-2-[1-[2-(furan-3-yl)-2-oxidanylidene-ethyl]-2-oxidanylidene-azepan-3-yl]-3-(2-methyl-1-benzofuran-5-yl)guanidine Openeye Name: 1-cyano-2-[1-[2-(3-furyl)-2-oxo-ethyl]-2-oxo-azepan-3-yl]-3-(2-methylbenzofuran-5-yl)guanidine CAS Name: 1-cyano-2-[1-[2-(3-furanyl)-2-oxoethyl]-2-oxo-3-azepanyl]-3-(2-methyl-5-benzofuranyl)guanidine IUPAC Name: 1-cyano-2-[1-[2-(furan-3-yl)-2-oxoethyl]-2-oxoazepan-3-yl]-3-(2-methyl-1-benzofuran-5-yl)guanidine Traditional Name: 1-cyano-2-[1-[2-(3-furyl)-2-keto-ethyl]-2-keto-azepan-3-yl]-3-(2-methylbenzofuran-5-yl)guanidine Formula: C23H23N5O4 MolecularWeight: 433.45982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(O1)C=CC(=C2)NC(=NC3CCCCN(C3=O)CC(=O)C4=COC=C4)NC#N

Isomeric SMILES

CC1=CC2=C(O1)C=CC(=C2)NC(=NC3CCCCN(C3=O)CC(=O)C4=COC=C4)NC#N

InChI

InChI=1S/C23H23N5O4/c1-15-10-17-11-18(5-6-21(17)32-15)26-23(25-14-24)27-19-4-2-3-8-28(22(19)30)12-20(29)16-7-9-31-13-16/h5-7,9-11,13,19H,2-4,8,12H2,1H3,(H2,25,26,27)