N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-[2-(allylamino)thiazol-4-yl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[2-(prop-2-enylamino)-4-thiazolyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-[2-(allylamino)thiazol-4-yl]phenyl]-piperonylamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C=CCNC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H17N3O3S/c1-2-8-21-20-23-16(11-27-20)13-4-3-5-15(9-13)22-19(24)14-6-7-17-18(10-14)26-12-25-17/h2-7,9-11H,1,8,12H2,(H,21,23)(H,22,24)