N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C18H13N5O3S MolecularWeight: 379.39252

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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)C4=CC(=NN4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=NN4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O3S/c1-10-2-7-13-15(8-10)27-18(20-13)11-3-5-12(6-4-11)19-17(24)14-9-16(22-21-14)23(25)26/h2-9H,1H3,(H,19,24)(H,21,22)