2-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide

Systemtic Name: 2-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: 2-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: 2-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: 2-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: 2-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C(C)CN4C(=CC(=N4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C(C)CN4C(=CC(=N4)[N+](=O)[O-])C

InChI

InChI=1S/C22H21N5O3S/c1-13-4-9-18-19(10-13)31-22(24-18)16-5-7-17(8-6-16)23-21(28)14(2)12-26-15(3)11-20(25-26)27(29)30/h4-11,14H,12H2,1-3H3,(H,23,28)