N-[4-[1-[[4-(1,3-benzoxazol-2-yl)phenyl]amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[1-[[4-(1,3-benzoxazol-2-yl)phenyl]amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]cyclopropanecarboxamide Openeye Name: N-[4-[2-[4-(1,3-benzoxazol-2-yl)anilino]-1-methyl-2-oxo-ethyl]sulfanylphenyl]cyclopropanecarboxamide CAS Name: N-[4-[[1-[4-(1,3-benzoxazol-2-yl)anilino]-1-oxopropan-2-yl]thio]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[1-[4-(1,3-benzoxazol-2-yl)anilino]-1-oxopropan-2-yl]sulfanylphenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[2-[4-(1,3-benzoxazol-2-yl)anilino]-2-keto-1-methyl-ethyl]thio]phenyl]cyclopropanecarboxamide Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2)SC4=CC=C(C=C4)NC(=O)C5CC5

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2)SC4=CC=C(C=C4)NC(=O)C5CC5

InChI

InChI=1S/C26H23N3O3S/c1-16(33-21-14-12-20(13-15-21)28-25(31)17-6-7-17)24(30)27-19-10-8-18(9-11-19)26-29-22-4-2-3-5-23(22)32-26/h2-5,8-17H,6-7H2,1H3,(H,27,30)(H,28,31)