5-tert-butyl-2-[(4-chlorophenyl)carbamoylamino]-N-pyridin-3-yl-thiophene-3-carboxamide

Systemtic Name: 5-tert-butyl-2-[(4-chlorophenyl)carbamoylamino]-N-pyridin-3-yl-thiophene-3-carboxamide Openeye Name: 5-tert-butyl-2-[(4-chlorophenyl)carbamoylamino]-N-(3-pyridyl)thiophene-3-carboxamide CAS Name: 5-tert-butyl-2-[[(4-chloroanilino)-oxomethyl]amino]-N-(3-pyridinyl)-3-thiophenecarboxamide IUPAC Name: 5-tert-butyl-2-[(4-chlorophenyl)carbamoylamino]-N-pyridin-3-ylthiophene-3-carboxamide Traditional Name: 5-tert-butyl-2-[(4-chlorophenyl)carbamoylamino]-N-(3-pyridyl)thiophene-3-carboxamide Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)NC(=O)NC2=CC=C(C=C2)Cl)C(=O)NC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)NC(=O)NC2=CC=C(C=C2)Cl)C(=O)NC3=CN=CC=C3

InChI

InChI=1S/C21H21ClN4O2S/c1-21(2,3)17-11-16(18(27)24-15-5-4-10-23-12-15)19(29-17)26-20(28)25-14-8-6-13(22)7-9-14/h4-12H,1-3H3,(H,24,27)(H2,25,26,28)