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

Systemtic Name: ethyl 2-[(cyclohexylcarbamoylamino)-(phenylcarbamoyl)amino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(cyclohexylcarbamoylamino)-(phenylcarbamoyl)amino]thiazole-4-carboxylate CAS Name: 2-[[anilino(oxo)methyl]-[[(cyclohexylamino)-oxomethyl]amino]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(cyclohexylcarbamoylamino)-(phenylcarbamoyl)amino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(cyclohexylcarbamoylamino)-(phenylcarbamoyl)amino]thiazole-4-carboxylic acid ethyl ester Formula: C20H25N5O4S MolecularWeight: 431.5086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N5O4S/c1-2-29-17(26)16-13-30-20(23-16)25(19(28)22-15-11-7-4-8-12-15)24-18(27)21-14-9-5-3-6-10-14/h4,7-8,11-14H,2-3,5-6,9-10H2,1H3,(H,22,28)(H2,21,24,27)