N-[3-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylamino]-3-oxidanylidene-propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylamino]-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylamino]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylamino]-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methylamino]-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylamino]-3-keto-propyl]thiophene-2-carboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)CCNC(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)CCNC(=O)C3=CC=CS3

InChI

InChI=1S/C21H24N4O2S/c1-15-18(16(2)25(24-15)14-17-7-4-3-5-8-17)13-23-20(26)10-11-22-21(27)19-9-6-12-28-19/h3-9,12H,10-11,13-14H2,1-2H3,(H,22,27)(H,23,26)