N-[4-(butylcarbamoylamino)cyclohexyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[4-(butylcarbamoylamino)cyclohexyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[4-(butylcarbamoylamino)cyclohexyl]-2-[(4-methylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[4-[[butylamino(oxo)methyl]amino]cyclohexyl]-2-[(4-methylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[4-(butylcarbamoylamino)cyclohexyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[4-(butylcarbamoylamino)cyclohexyl]-2-[(4-methylphenoxy)methyl]thiazole-4-carboxamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1CCC(CC1)NC(=O)C2=CSC(=N2)COC3=CC=C(C=C3)C

Isomeric SMILES

CCCCNC(=O)NC1CCC(CC1)NC(=O)C2=CSC(=N2)COC3=CC=C(C=C3)C

InChI

InChI=1S/C23H32N4O3S/c1-3-4-13-24-23(29)26-18-9-7-17(8-10-18)25-22(28)20-15-31-21(27-20)14-30-19-11-5-16(2)6-12-19/h5-6,11-12,15,17-18H,3-4,7-10,13-14H2,1-2H3,(H,25,28)(H2,24,26,29)