[[2-[(5-chloranylpyridin-2-yl)carbamoyl]-3-[[4-(dimethylamino)cyclohexyl]carbonylamino]-1-benzofuran-5-yl]-ethanoyl-amino] ethanoate

Systemtic Name: [[2-[(5-chloranylpyridin-2-yl)carbamoyl]-3-[[4-(dimethylamino)cyclohexyl]carbonylamino]-1-benzofuran-5-yl]-ethanoyl-amino] ethanoate Openeye Name: [acetyl-[2-[(5-chloro-2-pyridyl)carbamoyl]-3-[[4-(dimethylamino)cyclohexanecarbonyl]amino]benzofuran-5-yl]amino] acetate CAS Name: acetic acid [acetyl-[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-3-[[[4-(dimethylamino)cyclohexyl]-oxomethyl]amino]-5-benzofuranyl]amino] ester IUPAC Name: [acetyl-[2-[(5-chloropyridin-2-yl)carbamoyl]-3-[[4-(dimethylamino)cyclohexanecarbonyl]amino]-1-benzofuran-5-yl]amino] acetate Traditional Name: acetic acid [acetyl-[2-[(5-chloro-2-pyridyl)carbamoyl]-3-[[4-(dimethylamino)cyclohexanecarbonyl]amino]benzofuran-5-yl]amino] ester Formula: C27H30ClN5O6 MolecularWeight: 556.01

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC2=C(C=C1)OC(=C2NC(=O)C3CCC(CC3)N(C)C)C(=O)NC4=NC=C(C=C4)Cl)OC(=O)C

Isomeric SMILES

CC(=O)N(C1=CC2=C(C=C1)OC(=C2NC(=O)C3CCC(CC3)N(C)C)C(=O)NC4=NC=C(C=C4)Cl)OC(=O)C

InChI

InChI=1S/C27H30ClN5O6/c1-15(34)33(39-16(2)35)20-10-11-22-21(13-20)24(31-26(36)17-5-8-19(9-6-17)32(3)4)25(38-22)27(37)30-23-12-7-18(28)14-29-23/h7,10-14,17,19H,5-6,8-9H2,1-4H3,(H,31,36)(H,29,30,37)