3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-1-(6-nitro-2,3-dihydroindol-1-yl)propan-1-one

Systemtic Name: 3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-1-(6-nitro-2,3-dihydroindol-1-yl)propan-1-one Openeye Name: 3-[(2-methylthiazol-4-yl)methylsulfanyl]-1-(6-nitroindolin-1-yl)propan-1-one CAS Name: 3-[(2-methyl-4-thiazolyl)methylthio]-1-(6-nitro-2,3-dihydroindol-1-yl)-1-propanone IUPAC Name: 3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-1-(6-nitro-2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 3-[(2-methylthiazol-4-yl)methylthio]-1-(6-nitroindolin-1-yl)propan-1-one Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCCC(=O)N2CCC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)CSCCC(=O)N2CCC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O3S2/c1-11-17-13(10-24-11)9-23-7-5-16(20)18-6-4-12-2-3-14(19(21)22)8-15(12)18/h2-3,8,10H,4-7,9H2,1H3