N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]-1,3-thiazol-4-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]-1,3-thiazol-4-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(2-thioxo-1H-quinazolin-4-yl)amino]thiazol-4-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]-4-thiazolyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]-1,3-thiazol-4-yl]acetamide Traditional Name: N-piperonyl-2-[2-[(2-thioxo-1H-quinazolin-4-yl)amino]thiazol-4-yl]acetamide Formula: C21H17N5O3S2 MolecularWeight: 451.52138

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3=CSC(=N3)NC4=NC(=S)NC5=CC=CC=C54

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3=CSC(=N3)NC4=NC(=S)NC5=CC=CC=C54

InChI

InChI=1S/C21H17N5O3S2/c27-18(22-9-12-5-6-16-17(7-12)29-11-28-16)8-13-10-31-21(23-13)26-19-14-3-1-2-4-15(14)24-20(30)25-19/h1-7,10H,8-9,11H2,(H,22,27)(H2,23,24,25,26,30)