(2S)-2-[5-azanyl-1-(3,4-dichlorophenyl)-3-methyl-pyrazol-4-yl]-4H-1,4-benzothiazin-3-one

Systemtic Name: (2S)-2-[5-azanyl-1-(3,4-dichlorophenyl)-3-methyl-pyrazol-4-yl]-4H-1,4-benzothiazin-3-one Openeye Name: (2S)-2-[5-amino-1-(3,4-dichlorophenyl)-3-methyl-pyrazol-4-yl]-4H-1,4-benzothiazin-3-one CAS Name: (2S)-2-[5-amino-1-(3,4-dichlorophenyl)-3-methyl-4-pyrazolyl]-4H-1,4-benzothiazin-3-one IUPAC Name: (2S)-2-[5-amino-1-(3,4-dichlorophenyl)-3-methylpyrazol-4-yl]-4H-1,4-benzothiazin-3-one Traditional Name: (2S)-2-[5-amino-1-(3,4-dichlorophenyl)-3-methyl-pyrazol-4-yl]-4H-1,4-benzothiazin-3-one Formula: C18H14Cl2N4OS MolecularWeight: 405.30096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2C(=O)NC3=CC=CC=C3S2)N)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=NN(C(=C1[C@H]2C(=O)NC3=CC=CC=C3S2)N)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C18H14Cl2N4OS/c1-9-15(16-18(25)22-13-4-2-3-5-14(13)26-16)17(21)24(23-9)10-6-7-11(19)12(20)8-10/h2-8,16H,21H2,1H3,(H,22,25)/t16-/m0/s1