N'-[4-(2,5-dimethylpyrrol-1-yl)sulfonylphenyl]-2-propan-2-yl-2H-1,3,4-thiadiazole-3-carboximidamide

Systemtic Name: N'-[4-(2,5-dimethylpyrrol-1-yl)sulfonylphenyl]-2-propan-2-yl-2H-1,3,4-thiadiazole-3-carboximidamide Openeye Name: N'-[4-(2,5-dimethylpyrrol-1-yl)sulfonylphenyl]-2-isopropyl-2H-1,3,4-thiadiazole-3-carboxamidine CAS Name: N'-[4-[(2,5-dimethyl-1-pyrrolyl)sulfonyl]phenyl]-2-propan-2-yl-2H-1,3,4-thiadiazole-3-carboximidamide IUPAC Name: N'-[4-(2,5-dimethylpyrrol-1-yl)sulfonylphenyl]-2-propan-2-yl-2H-1,3,4-thiadiazole-3-carboximidamide Traditional Name: N'-[4-(2,5-dimethylpyrrol-1-yl)sulfonylphenyl]-2-isopropyl-2H-1,3,4-thiadiazole-3-carboxamidine Formula: C18H23N5O2S2 MolecularWeight: 405.53752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1S(=O)(=O)C2=CC=C(C=C2)N=C(N)N3C(SC=N3)C(C)C)C

Isomeric SMILES

CC1=CC=C(N1S(=O)(=O)C2=CC=C(C=C2)N=C(N)N3C(SC=N3)C(C)C)C

InChI

InChI=1S/C18H23N5O2S2/c1-12(2)17-22(20-11-26-17)18(19)21-15-7-9-16(10-8-15)27(24,25)23-13(3)5-6-14(23)4/h5-12,17H,1-4H3,(H2,19,21)