2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(2-methoxy-4-nitro-phenyl)ethanamide

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(2-methoxy-4-nitro-phenyl)ethanamide Openeye Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: 2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: 2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C17H18ClN3O4S MolecularWeight: 395.86052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN(CC=C)CC2=CC=C(S2)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN(CC=C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C17H18ClN3O4S/c1-3-8-20(10-13-5-7-16(18)26-13)11-17(22)19-14-6-4-12(21(23)24)9-15(14)25-2/h3-7,9H,1,8,10-11H2,2H3,(H,19,22)