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

Systemtic Name: 3-[(4-nitrophenyl)sulfonylamino]-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 3-[(4-nitrophenyl)sulfonylamino]-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-[(4-nitrophenyl)sulfonylamino]-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-[(4-nitrophenyl)sulfonylamino]-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-(nosylamino)-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C20H21N5O5S3 MolecularWeight: 507.60624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCSC2=NN=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCSC2=NN=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5S3/c26-18(12-13-21-33(29,30)17-10-8-16(9-11-17)25(27)28)22-19-23-24-20(32-19)31-14-4-7-15-5-2-1-3-6-15/h1-3,5-6,8-11,21H,4,7,12-14H2,(H,22,23,26)