N-[3-[[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]amino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C22H15N3O4S2 MolecularWeight: 449.5022

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC(=CC=C4)NC(=O)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC(=CC=C4)NC(=O)C5=CC=CS5

InChI

InChI=1S/C22H15N3O4S2/c26-20(14-3-1-4-15(9-14)23-21(27)19-5-2-8-30-19)25-22-24-16(11-31-22)13-6-7-17-18(10-13)29-12-28-17/h1-11H,12H2,(H,23,27)(H,24,25,26)