3-(1,3-benzodioxol-5-yl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H19N3O3S/c1-10(2)7-15-18-19-16(23-15)17-14(20)6-4-11-3-5-12-13(8-11)22-9-21-12/h3,5,8,10H,4,6-7,9H2,1-2H3,(H,17,19,20)