N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-4-phenylazanyl-benzamide

Systemtic Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-4-phenylazanyl-benzamide Openeye Name: 4-anilino-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide CAS Name: 4-anilino-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide IUPAC Name: 4-anilino-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-anilino-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Formula: C18H15N5O3S MolecularWeight: 381.4084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O3S/c24-16(20-18-22-21-17(27-18)11-6-7-11)12-8-9-14(15(10-12)23(25)26)19-13-4-2-1-3-5-13/h1-5,8-11,19H,6-7H2,(H,20,22,24)