N-[(S)-(4-chlorophenyl)-pyridin-4-yl-methyl]-2-cyclopropyl-1,3-benzoxazole-6-carboxamide

Systemtic Name: N-[(S)-(4-chlorophenyl)-pyridin-4-yl-methyl]-2-cyclopropyl-1,3-benzoxazole-6-carboxamide Openeye Name: N-[(S)-(4-chlorophenyl)-(4-pyridyl)methyl]-2-cyclopropyl-1,3-benzoxazole-6-carboxamide CAS Name: N-[(S)-(4-chlorophenyl)-pyridin-4-ylmethyl]-2-cyclopropyl-1,3-benzoxazole-6-carboxamide IUPAC Name: N-[(S)-(4-chlorophenyl)-pyridin-4-ylmethyl]-2-cyclopropyl-1,3-benzoxazole-6-carboxamide Traditional Name: N-[(S)-(4-chlorophenyl)-(4-pyridyl)methyl]-2-cyclopropyl-1,3-benzoxazole-6-carboxamide Formula: C23H18ClN3O2 MolecularWeight: 403.86092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(O2)C=C(C=C3)C(=O)NC(C4=CC=C(C=C4)Cl)C5=CC=NC=C5

Isomeric SMILES

C1CC1C2=NC3=C(O2)C=C(C=C3)C(=O)N[C@@H](C4=CC=C(C=C4)Cl)C5=CC=NC=C5

InChI

InChI=1S/C23H18ClN3O2/c24-18-6-3-14(4-7-18)21(15-9-11-25-12-10-15)27-22(28)17-5-8-19-20(13-17)29-23(26-19)16-1-2-16/h3-13,16,21H,1-2H2,(H,27,28)/t21-/m0/s1