N-[[4-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]methyl]thiophene-2-carboxamide Openeye Name: N-[[4-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]methyl]thiophene-2-carboxamide CAS Name: N-[[4-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-oxomethyl]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]benzyl]thiophene-2-carboxamide Formula: C22H19N3O3S2 MolecularWeight: 437.53456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H19N3O3S2/c1-2-28-16-9-10-17-19(12-16)30-22(24-17)25-20(26)15-7-5-14(6-8-15)13-23-21(27)18-4-3-11-29-18/h3-12H,2,13H2,1H3,(H,23,27)(H,24,25,26)