N-[3-methyl-1-oxidanylidene-1-[[3-(pyrrolidin-1-ylmethyl)phenyl]amino]butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[[3-(pyrrolidin-1-ylmethyl)phenyl]amino]butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-methyl-1-[[3-(pyrrolidin-1-ylmethyl)phenyl]carbamoyl]propyl]thiophene-2-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[3-(1-pyrrolidinylmethyl)anilino]butan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-[3-(pyrrolidin-1-ylmethyl)anilino]butan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-methyl-1-[[3-(pyrrolidinomethyl)phenyl]carbamoyl]propyl]thiophene-2-carboxamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)CN2CCCC2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=CC(=C1)CN2CCCC2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H27N3O2S/c1-15(2)19(23-20(25)18-9-6-12-27-18)21(26)22-17-8-5-7-16(13-17)14-24-10-3-4-11-24/h5-9,12-13,15,19H,3-4,10-11,14H2,1-2H3,(H,22,26)(H,23,25)