N-[4-(heptanoylamino)cyclohexyl]-2-[(4-propan-2-ylphenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[4-(heptanoylamino)cyclohexyl]-2-[(4-propan-2-ylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[4-(heptanoylamino)cyclohexyl]-2-[(4-isopropylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[4-(1-oxoheptylamino)cyclohexyl]-2-[(4-propan-2-ylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[4-(heptanoylamino)cyclohexyl]-2-[(4-propan-2-ylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[4-(enanthylamino)cyclohexyl]-2-[(4-isopropylphenoxy)methyl]thiazole-4-carboxamide Formula: C27H39N3O3S MolecularWeight: 485.68186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H39N3O3S/c1-4-5-6-7-8-25(31)28-21-11-13-22(14-12-21)29-27(32)24-18-34-26(30-24)17-33-23-15-9-20(10-16-23)19(2)3/h9-10,15-16,18-19,21-22H,4-8,11-14,17H2,1-3H3,(H,28,31)(H,29,32)