3-chloranyl-N-[4-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(5-isopropyl-1,3-benzoxazol-2-yl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(5-isopropyl-1,3-benzoxazol-2-yl)phenyl]benzothiophene-2-carboxamide Formula: C25H19ClN2O2S MolecularWeight: 446.94856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C25H19ClN2O2S/c1-14(2)16-9-12-20-19(13-16)28-25(30-20)15-7-10-17(11-8-15)27-24(29)23-22(26)18-5-3-4-6-21(18)31-23/h3-14H,1-2H3,(H,27,29)