ethyl 3-phenyl-6-[[2-[(phenylmethyl)carbamoylamino]-1,3-thiazol-4-yl]carbonylamino]hexanoate

Systemtic Name: ethyl 3-phenyl-6-[[2-[(phenylmethyl)carbamoylamino]-1,3-thiazol-4-yl]carbonylamino]hexanoate Openeye Name: ethyl 6-[[2-(benzylcarbamoylamino)thiazole-4-carbonyl]amino]-3-phenyl-hexanoate CAS Name: 6-[[oxo-[2-[[oxo-[(phenylmethyl)amino]methyl]amino]-4-thiazolyl]methyl]amino]-3-phenylhexanoic acid ethyl ester IUPAC Name: ethyl 6-[[2-(benzylcarbamoylamino)-1,3-thiazole-4-carbonyl]amino]-3-phenylhexanoate Traditional Name: 6-[[2-(benzylcarbamoylamino)thiazole-4-carbonyl]amino]-3-phenyl-hexanoic acid ethyl ester Formula: C26H30N4O4S MolecularWeight: 494.6058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CCCNC(=O)C1=CSC(=N1)NC(=O)NCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(CCCNC(=O)C1=CSC(=N1)NC(=O)NCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H30N4O4S/c1-2-34-23(31)16-21(20-12-7-4-8-13-20)14-9-15-27-24(32)22-18-35-26(29-22)30-25(33)28-17-19-10-5-3-6-11-19/h3-8,10-13,18,21H,2,9,14-17H2,1H3,(H,27,32)(H2,28,29,30,33)