2-[[(2S)-2-(1,3-benzodioxol-5-yloxy)propanoyl]amino]-5-propan-2-yl-thiophene-3-carboxamide

Systemtic Name: 2-[[(2S)-2-(1,3-benzodioxol-5-yloxy)propanoyl]amino]-5-propan-2-yl-thiophene-3-carboxamide Openeye Name: 2-[[(2S)-2-(1,3-benzodioxol-5-yloxy)propanoyl]amino]-5-isopropyl-thiophene-3-carboxamide CAS Name: 2-[[(2S)-2-(1,3-benzodioxol-5-yloxy)-1-oxopropyl]amino]-5-propan-2-yl-3-thiophenecarboxamide IUPAC Name: 2-[[(2S)-2-(1,3-benzodioxol-5-yloxy)propanoyl]amino]-5-propan-2-ylthiophene-3-carboxamide Traditional Name: 2-[[(2S)-2-(1,3-benzodioxol-5-yloxy)propanoyl]amino]-5-isopropyl-thiophene-3-carboxamide Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C(C)OC2=CC3=C(C=C2)OCO3)C(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(S1)C(C)C)C(=O)N)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N2O5S/c1-9(2)15-7-12(16(19)21)18(26-15)20-17(22)10(3)25-11-4-5-13-14(6-11)24-8-23-13/h4-7,9-10H,8H2,1-3H3,(H2,19,21)(H,20,22)/t10-/m0/s1