4-[(E)-3-[[4-(1,3-benzothiazol-2-yl)phenyl]amino]-3-oxidanylidene-prop-1-enyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[(E)-3-[[4-(1,3-benzothiazol-2-yl)phenyl]amino]-3-oxidanylidene-prop-1-enyl]-N-cyclopropyl-benzamide Openeye Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)anilino]-3-oxo-prop-1-enyl]-N-cyclopropyl-benzamide CAS Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)anilino]-3-oxoprop-1-enyl]-N-cyclopropylbenzamide IUPAC Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)anilino]-3-oxoprop-1-enyl]-N-cyclopropylbenzamide Traditional Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)anilino]-3-keto-prop-1-enyl]-N-cyclopropyl-benzamide Formula: C26H21N3O2S MolecularWeight: 439.52884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)C=CC(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)/C=C/C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H21N3O2S/c30-24(16-7-17-5-8-18(9-6-17)25(31)28-21-14-15-21)27-20-12-10-19(11-13-20)26-29-22-3-1-2-4-23(22)32-26/h1-13,16,21H,14-15H2,(H,27,30)(H,28,31)/b16-7+