3-nitro-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-nitro-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-nitro-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-nitro-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-nitro-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-nitro-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C17H15N5O3S MolecularWeight: 369.3977

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O3S/c23-15(13-7-4-8-14(11-13)22(24)25)19-17-21-20-16(26-17)18-10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H,18,20)(H,19,21,23)