4-methyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-1,3-thiazole

Systemtic Name: 4-methyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-1,3-thiazole Openeye Name: 4-methyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-thiazole CAS Name: 4-methyl-2-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]thio]thiazole IUPAC Name: 4-methyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-1,3-thiazole Traditional Name: 4-methyl-2-[(2-nitro-4-pyrrolidinosulfonyl-phenyl)thio]thiazole Formula: C14H15N3O4S3 MolecularWeight: 385.4816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O4S3/c1-10-9-22-14(15-10)23-13-5-4-11(8-12(13)17(18)19)24(20,21)16-6-2-3-7-16/h4-5,8-9H,2-3,6-7H2,1H3