N-[(2S)-3-methyl-1-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-3-methyl-1-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-2-methyl-1-[[4-(2-methylthiazol-4-yl)phenyl]carbamoyl]propyl]thiophene-2-carboxamide CAS Name: N-[(2S)-3-methyl-1-[4-(2-methyl-4-thiazolyl)anilino]-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-3-methyl-1-[4-(2-methyl-1,3-thiazol-4-yl)anilino]-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-2-methyl-1-[[4-(2-methylthiazol-4-yl)phenyl]carbamoyl]propyl]thiophene-2-carboxamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C(C(C)C)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)[C@H](C(C)C)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H21N3O2S2/c1-12(2)18(23-19(24)17-5-4-10-26-17)20(25)22-15-8-6-14(7-9-15)16-11-27-13(3)21-16/h4-12,18H,1-3H3,(H,22,25)(H,23,24)/t18-/m0/s1