N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-benzylsulfonyl-propanamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-benzylsulfonylpropanamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-benzylsulfonyl-propionamide Formula: C20H18N2O5S2 MolecularWeight: 430.49732

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)CCS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)CCS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H18N2O5S2/c23-19(8-9-29(24,25)12-14-4-2-1-3-5-14)22-20-21-16(11-28-20)15-6-7-17-18(10-15)27-13-26-17/h1-7,10-11H,8-9,12-13H2,(H,21,22,23)