3-(4-methoxyphenyl)sulfanyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 3-(4-methoxyphenyl)sulfanyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: 3-(4-methoxyphenyl)sulfanyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)propanamide CAS Name: 3-[(4-methoxyphenyl)thio]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)propanamide IUPAC Name: 3-(4-methoxyphenyl)sulfanyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: 3-[(4-methoxyphenyl)thio]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)propionamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CCSC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H17N3O4S2/c1-20-15-11-12(21(23)24)3-8-16(15)27-18(20)19-17(22)9-10-26-14-6-4-13(25-2)5-7-14/h3-8,11H,9-10H2,1-2H3