[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2-methyl-3-nitro-phenyl)methanone

Systemtic Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2-methyl-3-nitro-phenyl)methanone Openeye Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2-methyl-3-nitro-phenyl)methanone CAS Name: [2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-(2-methyl-3-nitrophenyl)methanone IUPAC Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2-methyl-3-nitrophenyl)methanone Traditional Name: [2-(1,3-benzothiazol-2-yl)pyrrolidino]-(2-methyl-3-nitro-phenyl)methanone Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCCC2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H17N3O3S/c1-12-13(6-4-8-15(12)22(24)25)19(23)21-11-5-9-16(21)18-20-14-7-2-3-10-17(14)26-18/h2-4,6-8,10,16H,5,9,11H2,1H3