N-[(1R)-1-cyclopropylethyl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[(1R)-1-cyclopropylethyl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-[(1R)-1-cyclopropylethyl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-[(1R)-1-cyclopropylethyl]-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C14H15N3O3S2 MolecularWeight: 337.4172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1CC1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O3S2/c1-8(9-2-3-9)15-13(18)7-21-14-16-11-5-4-10(17(19)20)6-12(11)22-14/h4-6,8-9H,2-3,7H2,1H3,(H,15,18)/t8-/m1/s1