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

Systemtic Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitro-4-piperidino-benzamide Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-])N2CC=C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-])N2CC=C

InChI

InChI=1S/C24H26N4O3S/c1-4-10-27-21-13-16(2)17(3)14-22(21)32-24(27)25-23(29)18-8-9-19(20(15-18)28(30)31)26-11-6-5-7-12-26/h4,8-9,13-15H,1,5-7,10-12H2,2-3H3