N-(1,3-benzodioxol-5-yl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-benzodioxol-5-yl)propanamide CAS Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-N-(1,3-benzodioxol-5-yl)propanamide IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-benzodioxol-5-yl)propanamide Traditional Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-N-(1,3-benzodioxol-5-yl)propionamide Formula: C18H16N4O3S2 MolecularWeight: 400.47464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NN=C(S3)NC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NN=C(S3)NC4=CC=CC=C4

InChI

InChI=1S/C18H16N4O3S2/c1-11(16(23)19-13-7-8-14-15(9-13)25-10-24-14)26-18-22-21-17(27-18)20-12-5-3-2-4-6-12/h2-9,11H,10H2,1H3,(H,19,23)(H,20,21)