2-[6-[[2,6-di(propan-2-yl)phenyl]amino]-6-oxidanylidene-hexyl]sulfanyl-N-ethoxy-1,3-benzoxazole-7-carboxamide

Systemtic Name: 2-[6-[[2,6-di(propan-2-yl)phenyl]amino]-6-oxidanylidene-hexyl]sulfanyl-N-ethoxy-1,3-benzoxazole-7-carboxamide Openeye Name: 2-[6-(2,6-diisopropylanilino)-6-oxo-hexyl]sulfanyl-N-ethoxy-1,3-benzoxazole-7-carboxamide CAS Name: 2-[[6-[2,6-di(propan-2-yl)anilino]-6-oxohexyl]thio]-N-ethoxy-1,3-benzoxazole-7-carboxamide IUPAC Name: 2-[6-[2,6-di(propan-2-yl)anilino]-6-oxohexyl]sulfanyl-N-ethoxy-1,3-benzoxazole-7-carboxamide Traditional Name: 2-[[6-(2,6-diisopropylanilino)-6-keto-hexyl]thio]-N-ethoxy-1,3-benzoxazole-7-carboxamide Formula: C28H37N3O4S MolecularWeight: 511.67608

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Descriptors Computed from Structure

Canonical SMILES:

CCONC(=O)C1=C2C(=CC=C1)N=C(O2)SCCCCCC(=O)NC3=C(C=CC=C3C(C)C)C(C)C

Isomeric SMILES

CCONC(=O)C1=C2C(=CC=C1)N=C(O2)SCCCCCC(=O)NC3=C(C=CC=C3C(C)C)C(C)C

InChI

InChI=1S/C28H37N3O4S/c1-6-34-31-27(33)22-14-11-15-23-26(22)35-28(29-23)36-17-9-7-8-16-24(32)30-25-20(18(2)3)12-10-13-21(25)19(4)5/h10-15,18-19H,6-9,16-17H2,1-5H3,(H,30,32)(H,31,33)