N-(6-butyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-methyl-1,2-oxazole-5-carboxamide

Systemtic Name: N-(6-butyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-methyl-1,2-oxazole-5-carboxamide Openeye Name: N-(3-allyl-6-butyl-1,3-benzothiazol-2-ylidene)-3-methyl-isoxazole-5-carboxamide CAS Name: N-(6-butyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-methyl-5-isoxazolecarboxamide IUPAC Name: N-(6-butyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-methyl-1,2-oxazole-5-carboxamide Traditional Name: N-(3-allyl-6-butyl-1,3-benzothiazol-2-ylidene)-3-methyl-isoxazole-5-carboxamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=NO3)C)S2)CC=C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=NO3)C)S2)CC=C

InChI

InChI=1S/C19H21N3O2S/c1-4-6-7-14-8-9-15-17(12-14)25-19(22(15)10-5-2)20-18(23)16-11-13(3)21-24-16/h5,8-9,11-12H,2,4,6-7,10H2,1,3H3