N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-3-(cyclohexylcarbamoylamino)propanamide

Systemtic Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-3-(cyclohexylcarbamoylamino)propanamide Openeye Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-3-(cyclohexylcarbamoylamino)propanamide CAS Name: N-[4-[4-(acetamidomethyl)phenyl]-2-thiazolyl]-3-[[(cyclohexylamino)-oxomethyl]amino]propanamide IUPAC Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-3-(cyclohexylcarbamoylamino)propanamide Traditional Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-3-(cyclohexylcarbamoylamino)propionamide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCNC(=O)NC3CCCCC3

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCNC(=O)NC3CCCCC3

InChI

InChI=1S/C22H29N5O3S/c1-15(28)24-13-16-7-9-17(10-8-16)19-14-31-22(26-19)27-20(29)11-12-23-21(30)25-18-5-3-2-4-6-18/h7-10,14,18H,2-6,11-13H2,1H3,(H,24,28)(H2,23,25,30)(H,26,27,29)