N-[2-(cyclohexen-1-yl)ethyl]-2-[2-(pyridin-4-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]ethanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[2-(pyridin-4-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]ethanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[2-(4-pyridylmethylcarbamoylamino)thiazol-4-yl]acetamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[2-[[oxo-(pyridin-4-ylmethylamino)methyl]amino]-4-thiazolyl]acetamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[2-(pyridin-4-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]acetamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[2-(4-pyridylmethylcarbamoylamino)thiazol-4-yl]acetamide Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)CC2=CSC(=N2)NC(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)CC2=CSC(=N2)NC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C20H25N5O2S/c26-18(22-11-8-15-4-2-1-3-5-15)12-17-14-28-20(24-17)25-19(27)23-13-16-6-9-21-10-7-16/h4,6-7,9-10,14H,1-3,5,8,11-13H2,(H,22,26)(H2,23,24,25,27)