N-[1-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[1-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]amino]-3-methyl-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-methyl-1-[(4-methyl-5-piperonyl-thiazol-2-yl)carbamoyl]propyl]thiophene-2-carboxamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C(C(C)C)NC(=O)C2=CC=CS2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(C(C)C)NC(=O)C2=CC=CS2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H23N3O4S2/c1-12(2)19(24-20(26)17-5-4-8-30-17)21(27)25-22-23-13(3)18(31-22)10-14-6-7-15-16(9-14)29-11-28-15/h4-9,12,19H,10-11H2,1-3H3,(H,24,26)(H,23,25,27)