N-[3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-3-keto-propyl]thiophene-3-carboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=O)CCNC(=O)C3=CSC=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=O)CCNC(=O)C3=CSC=C3

InChI

InChI=1S/C21H24N4O2S/c1-15-19(16(2)25(23-15)18-7-5-4-6-8-18)13-24(3)20(26)9-11-22-21(27)17-10-12-28-14-17/h4-8,10,12,14H,9,11,13H2,1-3H3,(H,22,27)