7-methoxy-N-[(2S)-4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(1,3-thiazol-2-ylsulfonyl)azepan-4-yl]amino]pentan-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 7-methoxy-N-[(2S)-4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(1,3-thiazol-2-ylsulfonyl)azepan-4-yl]amino]pentan-2-yl]-1-benzofuran-2-carboxamide Openeye Name: 7-methoxy-N-[(1S)-3-methyl-1-[(3-oxo-1-thiazol-2-ylsulfonyl-azepan-4-yl)carbamoyl]butyl]benzofuran-2-carboxamide CAS Name: 7-methoxy-N-[(2S)-4-methyl-1-oxo-1-[[3-oxo-1-(2-thiazolylsulfonyl)-4-azepanyl]amino]pentan-2-yl]-2-benzofurancarboxamide IUPAC Name: 7-methoxy-N-[(2S)-4-methyl-1-oxo-1-[[3-oxo-1-(1,3-thiazol-2-ylsulfonyl)azepan-4-yl]amino]pentan-2-yl]-1-benzofuran-2-carboxamide Traditional Name: N-[(1S)-1-[(3-keto-1-thiazol-2-ylsulfonyl-azepan-4-yl)carbamoyl]-3-methyl-butyl]-7-methoxy-coumarilamide Formula: C25H30N4O7S2 MolecularWeight: 562.6583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=NC=CS2)NC(=O)C3=CC4=C(O3)C(=CC=C4)OC

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=NC=CS2)NC(=O)C3=CC4=C(O3)C(=CC=C4)OC

InChI

InChI=1S/C25H30N4O7S2/c1-15(2)12-18(28-24(32)21-13-16-6-4-8-20(35-3)22(16)36-21)23(31)27-17-7-5-10-29(14-19(17)30)38(33,34)25-26-9-11-37-25/h4,6,8-9,11,13,15,17-18H,5,7,10,12,14H2,1-3H3,(H,27,31)(H,28,32)/t17?,18-/m0/s1