N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)-9H-xanthene-9-carboxamide

Systemtic Name: N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)-9H-xanthene-9-carboxamide Openeye Name: N-[5-(1-methylbutyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide CAS Name: N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)-9H-xanthene-9-carboxamide IUPAC Name: N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)-9H-xanthene-9-carboxamide Traditional Name: N-[5-(1-methylbutyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=NN=C(S1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

CCCC(C)C1=NN=C(S1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C21H21N3O2S/c1-3-8-13(2)20-23-24-21(27-20)22-19(25)18-14-9-4-6-11-16(14)26-17-12-7-5-10-15(17)18/h4-7,9-13,18H,3,8H2,1-2H3,(H,22,24,25)