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

Systemtic Name: 3-nitro-4-phenylazanyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-anilino-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide CAS Name: 4-anilino-3-nitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-anilino-3-nitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-anilino-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O3S/c1-11(2)17-21-22-18(27-17)20-16(24)12-8-9-14(15(10-12)23(25)26)19-13-6-4-3-5-7-13/h3-11,19H,1-2H3,(H,20,22,24)