(3,4-diethoxyphenyl)-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone

Systemtic Name: (3,4-diethoxyphenyl)-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone Openeye Name: (3,4-diethoxyphenyl)-[4-[5-(2-thienyl)-6H-1,3,4-thiadiazin-2-yl]piperazin-1-yl]methanone CAS Name: (3,4-diethoxyphenyl)-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)-1-piperazinyl]methanone IUPAC Name: (3,4-diethoxyphenyl)-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone Traditional Name: (3,4-diethoxyphenyl)-[4-[5-(2-thienyl)-6H-1,3,4-thiadiazin-2-yl]piperazino]methanone Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NN=C(CS3)C4=CC=CS4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NN=C(CS3)C4=CC=CS4)OCC

InChI

InChI=1S/C22H26N4O3S2/c1-3-28-18-8-7-16(14-19(18)29-4-2)21(27)25-9-11-26(12-10-25)22-24-23-17(15-31-22)20-6-5-13-30-20/h5-8,13-14H,3-4,9-12,15H2,1-2H3