N-(6-propan-2-yl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(6-propan-2-yl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(3-allyl-6-isopropyl-1,3-benzothiazol-2-ylidene)-1,3-benzodioxole-5-carboxamide CAS Name: N-(6-propan-2-yl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(6-propan-2-yl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-allyl-6-isopropyl-1,3-benzothiazol-2-ylidene)-piperonylamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(C=C3)OCO4)S2)CC=C

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(C=C3)OCO4)S2)CC=C

InChI

InChI=1S/C21H20N2O3S/c1-4-9-23-16-7-5-14(13(2)3)11-19(16)27-21(23)22-20(24)15-6-8-17-18(10-15)26-12-25-17/h4-8,10-11,13H,1,9,12H2,2-3H3