N-[(2S)-5-(diethylamino)pentan-2-yl]-5-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-carboxamide

Systemtic Name: N-[(2S)-5-(diethylamino)pentan-2-yl]-5-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-carboxamide Openeye Name: N-[(1S)-4-(diethylamino)-1-methyl-butyl]-5-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-carboxamide CAS Name: N-[(2S)-5-(diethylamino)pentan-2-yl]-5-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-2-furancarboxamide IUPAC Name: N-[(2S)-5-(diethylamino)pentan-2-yl]-5-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-carboxamide Traditional Name: N-[(1S)-4-(diethylamino)-1-methyl-butyl]-5-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-2-furamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)C1=CC=C(O1)CSC2=NC3=C(C=CC=C3O2)C

Isomeric SMILES

CCN(CC)CCC[C@H](C)NC(=O)C1=CC=C(O1)CSC2=NC3=C(C=CC=C3O2)C

InChI

InChI=1S/C23H31N3O3S/c1-5-26(6-2)14-8-10-17(4)24-22(27)20-13-12-18(28-20)15-30-23-25-21-16(3)9-7-11-19(21)29-23/h7,9,11-13,17H,5-6,8,10,14-15H2,1-4H3,(H,24,27)/t17-/m0/s1