N-[(2S)-3-methyl-1-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-1-oxidanylidene-butan-2-yl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(2S)-3-methyl-1-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-1-oxidanylidene-butan-2-yl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(1S)-2-methyl-1-[methyl-[(3-methyl-2-thienyl)methyl]carbamoyl]propyl]-3-morpholinosulfonyl-benzamide CAS Name: N-[(2S)-3-methyl-1-[methyl-[(3-methyl-2-thiophenyl)methyl]amino]-1-oxobutan-2-yl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(2S)-3-methyl-1-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-1-oxobutan-2-yl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(1S)-2-methyl-1-[methyl-[(3-methyl-2-thienyl)methyl]carbamoyl]propyl]-3-morpholinosulfonyl-benzamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)C(=O)C(C(C)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(SC=C1)CN(C)C(=O)[C@H](C(C)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C23H31N3O5S2/c1-16(2)21(23(28)25(4)15-20-17(3)8-13-32-20)24-22(27)18-6-5-7-19(14-18)33(29,30)26-9-11-31-12-10-26/h5-8,13-14,16,21H,9-12,15H2,1-4H3,(H,24,27)/t21-/m0/s1