2-methoxy-N-[(2R)-4-methylsulfanyl-1-[[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[(2R)-4-methylsulfanyl-1-[[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[(1R)-3-methylsulfanyl-1-[[(2S)-2-morpholino-2-(2-thienyl)ethyl]carbamoyl]propyl]benzamide CAS Name: 2-methoxy-N-[(2R)-4-(methylthio)-1-[[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]amino]-1-oxobutan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[(2R)-4-methylsulfanyl-1-[[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]-1-oxobutan-2-yl]benzamide Traditional Name: 2-methoxy-N-[(1R)-3-(methylthio)-1-[[(2S)-2-morpholino-2-(2-thienyl)ethyl]carbamoyl]propyl]benzamide Formula: C23H31N3O4S2 MolecularWeight: 477.63994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC(C2=CC=CS2)N3CCOCC3

Isomeric SMILES

COC1=CC=CC=C1C(=O)N[C@H](CCSC)C(=O)NC[C@@H](C2=CC=CS2)N3CCOCC3

InChI

InChI=1S/C23H31N3O4S2/c1-29-20-7-4-3-6-17(20)22(27)25-18(9-15-31-2)23(28)24-16-19(21-8-5-14-32-21)26-10-12-30-13-11-26/h3-8,14,18-19H,9-13,15-16H2,1-2H3,(H,24,28)(H,25,27)/t18-,19+/m1/s1