2-azanyl-N-[1-(3-methylthiophen-2-yl)-1-phenyl-propan-2-yl]ethanamide; (E)-but-2-enedioic acid

Systemtic Name: 2-azanyl-N-[1-(3-methylthiophen-2-yl)-1-phenyl-propan-2-yl]ethanamide; (E)-but-2-enedioic acid Openeye Name: 2-amino-N-[1-methyl-2-(3-methyl-2-thienyl)-2-phenyl-ethyl]acetamide; fumaric acid CAS Name: 2-amino-N-[1-(3-methyl-2-thiophenyl)-1-phenylpropan-2-yl]acetamide; (E)-2-butenedioic acid IUPAC Name: 2-amino-N-[1-(3-methylthiophen-2-yl)-1-phenylpropan-2-yl]acetamide; (E)-but-2-enedioic acid Traditional Name: 2-amino-N-[1-methyl-2-(3-methyl-2-thienyl)-2-phenyl-ethyl]acetamide; fumaric acid Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CC=CC=C2)C(C)NC(=O)CN.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(C2=CC=CC=C2)C(C)NC(=O)CN.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C16H20N2OS.C4H4O4/c1-11-8-9-20-16(11)15(12(2)18-14(19)10-17)13-6-4-3-5-7-13;5-3(6)1-2-4(7)8/h3-9,12,15H,10,17H2,1-2H3,(H,18,19);1-2H,(H,5,6)(H,7,8)/b;2-1+