N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide CAS Name: N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[5-[(4-sulfamoylbenzyl)amino]-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide Formula: C18H15N5O3S3 MolecularWeight: 445.5384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C(=O)NC3=NN=C(S3)NCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C(=O)NC3=NN=C(S3)NCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C18H15N5O3S3/c19-29(25,26)13-7-5-11(6-8-13)10-20-17-22-23-18(28-17)21-16(24)15-9-12-3-1-2-4-14(12)27-15/h1-9H,10H2,(H,20,22)(H2,19,25,26)(H,21,23,24)