N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-morpholino-3-nitro-benzamide CAS Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-morpholino-3-nitro-benzamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])N2CC=C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])N2CC=C

InChI

InChI=1S/C23H24N4O4S/c1-4-7-26-20-12-15(2)16(3)13-21(20)32-23(26)24-22(28)17-5-6-18(19(14-17)27(29)30)25-8-10-31-11-9-25/h4-6,12-14H,1,7-11H2,2-3H3