ethyl 2-[(cyclohexylcarbamoylamino)-[(4-methylphenyl)carbamoyl]amino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[(cyclohexylcarbamoylamino)-[(4-methylphenyl)carbamoyl]amino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(cyclohexylcarbamoylamino)-(p-tolylcarbamoyl)amino]thiazole-4-carboxylate CAS Name: 2-[[[(cyclohexylamino)-oxomethyl]amino]-[(4-methylanilino)-oxomethyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(cyclohexylcarbamoylamino)-[(4-methylphenyl)carbamoyl]amino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(cyclohexylcarbamoylamino)-(p-tolylcarbamoyl)amino]thiazole-4-carboxylic acid ethyl ester Formula: C21H27N5O4S MolecularWeight: 445.53518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)N(C(=O)NC2=CC=C(C=C2)C)NC(=O)NC3CCCCC3

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)N(C(=O)NC2=CC=C(C=C2)C)NC(=O)NC3CCCCC3

InChI

InChI=1S/C21H27N5O4S/c1-3-30-18(27)17-13-31-21(24-17)26(20(29)23-16-11-9-14(2)10-12-16)25-19(28)22-15-7-5-4-6-8-15/h9-13,15H,3-8H2,1-2H3,(H,23,29)(H2,22,25,28)