N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-5-chloro-2,3-dihydrobenzofuran-2-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-5-chloro-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-5-chloro-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-(4-methyl-5-piperonyl-thiazol-2-yl)coumaran-2-carboxamide Formula: C21H17ClN2O4S MolecularWeight: 428.88868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2CC3=C(O2)C=CC(=C3)Cl)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2CC3=C(O2)C=CC(=C3)Cl)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H17ClN2O4S/c1-11-19(7-12-2-4-16-17(6-12)27-10-26-16)29-21(23-11)24-20(25)18-9-13-8-14(22)3-5-15(13)28-18/h2-6,8,18H,7,9-10H2,1H3,(H,23,24,25)