N-[2-[[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]amino]-2-oxidanylidene-ethyl]-N-(1-benzofuran-5-yl)-4-cyano-cyclohexane-1-carboxamide hydrochloride

Systemtic Name: N-[2-[[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]amino]-2-oxidanylidene-ethyl]-N-(1-benzofuran-5-yl)-4-cyano-cyclohexane-1-carboxamide hydrochloride Openeye Name: N-[2-[4-(2-aminothiazol-4-yl)anilino]-2-oxo-ethyl]-N-(benzofuran-5-yl)-4-cyano-cyclohexanecarboxamide hydrochloride CAS Name: N-[2-[4-(2-amino-4-thiazolyl)anilino]-2-oxoethyl]-N-(5-benzofuranyl)-4-cyano-1-cyclohexanecarboxamide hydrochloride IUPAC Name: N-[2-[4-(2-amino-1,3-thiazol-4-yl)anilino]-2-oxoethyl]-N-(1-benzofuran-5-yl)-4-cyanocyclohexane-1-carboxamide hydrochloride Traditional Name: N-[2-[4-(2-aminothiazol-4-yl)anilino]-2-keto-ethyl]-N-(benzofuran-5-yl)-4-cyano-cyclohexanecarboxamide hydrochloride Formula: C27H26ClN5O3S MolecularWeight: 536.04504

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C#N)C(=O)N(CC(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N)C4=CC5=C(C=C4)OC=C5.Cl

Isomeric SMILES

C1CC(CCC1C#N)C(=O)N(CC(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N)C4=CC5=C(C=C4)OC=C5.Cl

InChI

InChI=1S/C27H25N5O3S.ClH/c28-14-17-1-3-19(4-2-17)26(34)32(22-9-10-24-20(13-22)11-12-35-24)15-25(33)30-21-7-5-18(6-8-21)23-16-36-27(29)31-23;/h5-13,16-17,19H,1-4,15H2,(H2,29,31)(H,30,33);1H