N-[5-(2,3-dihydro-1H-inden-1-ylamino)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide

Systemtic Name: N-[5-(2,3-dihydro-1H-inden-1-ylamino)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[5-(indan-1-ylamino)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide CAS Name: N-[5-(2,3-dihydro-1H-inden-1-ylamino)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide IUPAC Name: N-[5-(2,3-dihydro-1H-inden-1-ylamino)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[5-(indan-1-ylamino)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Formula: C18H15N5O3S MolecularWeight: 381.4084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C1NC3=NN=C(S3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2C1NC3=NN=C(S3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

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