N-[1-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[1-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[1-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamoyl]-3-methylsulfanyl-propyl]-3-morpholinosulfonyl-benzamide CAS Name: N-[1-[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-4-(methylthio)-1-oxobutan-2-yl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[1-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[1-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamoyl]-3-(methylthio)propyl]-3-morpholinosulfonyl-benzamide Formula: C26H30N4O6S3 MolecularWeight: 590.7346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(CCSC)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(CCSC)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C26H30N4O6S3/c1-35-20-8-6-18(7-9-20)23-17-38-26(28-23)29-25(32)22(10-15-37-2)27-24(31)19-4-3-5-21(16-19)39(33,34)30-11-13-36-14-12-30/h3-9,16-17,22H,10-15H2,1-2H3,(H,27,31)(H,28,29,32)