4-(2-azanylpyridin-4-yl)-3-[(4-chlorophenyl)amino]-N-ethyl-5-(nitromethyl)thiophene-2-carboxamide

Systemtic Name: 4-(2-azanylpyridin-4-yl)-3-[(4-chlorophenyl)amino]-N-ethyl-5-(nitromethyl)thiophene-2-carboxamide Openeye Name: 4-(2-amino-4-pyridyl)-3-(4-chloroanilino)-N-ethyl-5-(nitromethyl)thiophene-2-carboxamide CAS Name: 4-(2-amino-4-pyridinyl)-3-(4-chloroanilino)-N-ethyl-5-(nitromethyl)-2-thiophenecarboxamide IUPAC Name: 4-(2-aminopyridin-4-yl)-3-(4-chloroanilino)-N-ethyl-5-(nitromethyl)thiophene-2-carboxamide Traditional Name: 4-(2-amino-4-pyridyl)-3-(4-chloroanilino)-N-ethyl-5-(nitromethyl)thiophene-2-carboxamide Formula: C19H18ClN5O3S MolecularWeight: 431.89592

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(C(=C(S1)C[N+](=O)[O-])C2=CC(=NC=C2)N)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCNC(=O)C1=C(C(=C(S1)C[N+](=O)[O-])C2=CC(=NC=C2)N)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN5O3S/c1-2-22-19(26)18-17(24-13-5-3-12(20)4-6-13)16(14(29-18)10-25(27)28)11-7-8-23-15(21)9-11/h3-9,24H,2,10H2,1H3,(H2,21,23)(H,22,26)