2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(2,3-dimethyl-6-nitro-phenyl)ethanamide

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(2,3-dimethyl-6-nitro-phenyl)ethanamide Openeye Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(2,3-dimethyl-6-nitro-phenyl)acetamide CAS Name: 2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-N-(2,3-dimethyl-6-nitrophenyl)acetamide IUPAC Name: 2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-N-(2,3-dimethyl-6-nitrophenyl)acetamide Traditional Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(2,3-dimethyl-6-nitro-phenyl)acetamide Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CN(CC=C)CC2=CC=C(S2)Cl)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CN(CC=C)CC2=CC=C(S2)Cl)C

InChI

InChI=1S/C18H20ClN3O3S/c1-4-9-21(10-14-6-8-16(19)26-14)11-17(23)20-18-13(3)12(2)5-7-15(18)22(24)25/h4-8H,1,9-11H2,2-3H3,(H,20,23)