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

Systemtic Name: 3-methyl-N-(6-nitro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1,2-oxazole-5-carboxamide Openeye Name: N-(3-allyl-6-nitro-1,3-benzothiazol-2-ylidene)-3-methyl-isoxazole-5-carboxamide CAS Name: 3-methyl-N-(6-nitro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-5-isoxazolecarboxamide IUPAC Name: 3-methyl-N-(6-nitro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1,2-oxazole-5-carboxamide Traditional Name: N-(3-allyl-6-nitro-1,3-benzothiazol-2-ylidene)-3-methyl-isoxazole-5-carboxamide Formula: C15H12N4O4S MolecularWeight: 344.34518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)[N+](=O)[O-])CC=C

Isomeric SMILES

CC1=NOC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)[N+](=O)[O-])CC=C

InChI

InChI=1S/C15H12N4O4S/c1-3-6-18-11-5-4-10(19(21)22)8-13(11)24-15(18)16-14(20)12-7-9(2)17-23-12/h3-5,7-8H,1,6H2,2H3