N-[(2-chloranyl-5-nitro-phenyl)methyl]-5-(cyclopropylcarbonylamino)-N,3-dimethyl-thiophene-2-carboxamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-5-(cyclopropylcarbonylamino)-N,3-dimethyl-thiophene-2-carboxamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-5-(cyclopropanecarbonylamino)-N,3-dimethyl-thiophene-2-carboxamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-5-[[cyclopropyl(oxo)methyl]amino]-N,3-dimethyl-2-thiophenecarboxamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-5-(cyclopropanecarbonylamino)-N,3-dimethylthiophene-2-carboxamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-5-(cyclopropanecarbonylamino)-N,3-dimethyl-thiophene-2-carboxamide Formula: C18H18ClN3O4S MolecularWeight: 407.87122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)N(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)N(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18ClN3O4S/c1-10-7-15(20-17(23)11-3-4-11)27-16(10)18(24)21(2)9-12-8-13(22(25)26)5-6-14(12)19/h5-8,11H,3-4,9H2,1-2H3,(H,20,23)