N-(1-cyanocycloheptyl)-2-[[(4-ethylphenyl)-thiophen-2-yl-methyl]amino]ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-[[(4-ethylphenyl)-thiophen-2-yl-methyl]amino]ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-[[(4-ethylphenyl)-(2-thienyl)methyl]amino]acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[[(4-ethylphenyl)-thiophen-2-ylmethyl]amino]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-[[(4-ethylphenyl)-thiophen-2-ylmethyl]amino]acetamide Traditional Name: N-(1-cyanocycloheptyl)-2-[[(4-ethylphenyl)-(2-thienyl)methyl]amino]acetamide Formula: C23H29N3OS MolecularWeight: 395.56086

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3(CCCCCC3)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3(CCCCCC3)C#N

InChI

InChI=1S/C23H29N3OS/c1-2-18-9-11-19(12-10-18)22(20-8-7-15-28-20)25-16-21(27)26-23(17-24)13-5-3-4-6-14-23/h7-12,15,22,25H,2-6,13-14,16H2,1H3,(H,26,27)