2-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C18H13N5O3S3 MolecularWeight: 443.52252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H13N5O3S3/c1-10(27-18-19-13-7-2-3-8-14(13)28-18)15(24)20-17-22-21-16(29-17)11-5-4-6-12(9-11)23(25)26/h2-10H,1H3,(H,20,22,24)