N-[[3-(2-chloranylprop-2-enoxy)-4-methoxy-phenyl]methyl]-5-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]thiophene-2-carboxamide

Systemtic Name: N-[[3-(2-chloranylprop-2-enoxy)-4-methoxy-phenyl]methyl]-5-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]thiophene-2-carboxamide Openeye Name: N-[[3-(2-chloroallyloxy)-4-methoxy-phenyl]methyl]-5-methyl-N-[(3S)-2-oxoazepan-3-yl]thiophene-2-carboxamide CAS Name: N-[[3-(2-chloroprop-2-enoxy)-4-methoxyphenyl]methyl]-5-methyl-N-[(3S)-2-oxo-3-azepanyl]-2-thiophenecarboxamide IUPAC Name: N-[[3-(2-chloroprop-2-enoxy)-4-methoxyphenyl]methyl]-5-methyl-N-[(3S)-2-oxoazepan-3-yl]thiophene-2-carboxamide Traditional Name: N-[3-(2-chloroallyloxy)-4-methoxy-benzyl]-N-[(3S)-2-ketoazepan-3-yl]-5-methyl-thiophene-2-carboxamide Formula: C23H27ClN2O4S MolecularWeight: 462.98948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)N(CC2=CC(=C(C=C2)OC)OCC(=C)Cl)C3CCCCNC3=O

Isomeric SMILES

CC1=CC=C(S1)C(=O)N(CC2=CC(=C(C=C2)OC)OCC(=C)Cl)[C@H]3CCCCNC3=O

InChI

InChI=1S/C23H27ClN2O4S/c1-15(24)14-30-20-12-17(8-9-19(20)29-3)13-26(18-6-4-5-11-25-22(18)27)23(28)21-10-7-16(2)31-21/h7-10,12,18H,1,4-6,11,13-14H2,2-3H3,(H,25,27)/t18-/m0/s1