N-[(2S)-butan-2-yl]-2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[(1S)-1-methylpropyl]thiazole-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-2-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-[(1S)-1-methylpropyl]thiazole-4-carboxamide Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CSC(=N1)CSC2=NC3=C(O2)C=CC(=C3)C

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CSC(=N1)CSC2=NC3=C(O2)C=CC(=C3)C

InChI

InChI=1S/C17H19N3O2S2/c1-4-11(3)18-16(21)13-8-23-15(19-13)9-24-17-20-12-7-10(2)5-6-14(12)22-17/h5-8,11H,4,9H2,1-3H3,(H,18,21)/t11-/m0/s1