N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanamide

Systemtic Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanamide Openeye Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[5-(3-thienyl)tetrazol-2-yl]acetamide CAS Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)-2-[5-(3-thiophenyl)-2-tetrazolyl]acetamide IUPAC Name: N-(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)-2-(5-thiophen-3-yltetrazol-2-yl)acetamide Traditional Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[5-(3-thienyl)tetrazol-2-yl]acetamide Formula: C20H23N7OS MolecularWeight: 409.50792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2N=C(N=N2)C3=CSC=C3)C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2N=C(N=N2)C3=CSC=C3)C4CCCCC4)C

InChI

InChI=1S/C20H23N7OS/c1-13-14(2)27(16-6-4-3-5-7-16)20(17(13)10-21)22-18(28)11-26-24-19(23-25-26)15-8-9-29-12-15/h8-9,12,16H,3-7,11H2,1-2H3,(H,22,28)