3-azanyl-2-(phenylcarbonyl)-4-(1-piperidin-1-ylethylideneamino)thieno[2,3-b]thiophene-5-carboxylate; piperidin-1-ium

Systemtic Name: 3-azanyl-2-(phenylcarbonyl)-4-(1-piperidin-1-ylethylideneamino)thieno[2,3-b]thiophene-5-carboxylate; piperidin-1-ium Openeye Name: 3-amino-2-benzoyl-4-[1-(1-piperidyl)ethylideneamino]thieno[2,3-b]thiophene-5-carboxylate; piperidin-1-ium CAS Name: 3-amino-2-benzoyl-4-[1-(1-piperidinyl)ethylideneamino]-5-thieno[2,3-b]thiophenecarboxylate; piperidin-1-ium IUPAC Name: 3-amino-2-benzoyl-4-(1-piperidin-1-ylethylideneamino)thieno[2,3-b]thiophene-5-carboxylate; piperidin-1-ium Traditional Name: 3-amino-2-benzoyl-4-(1-piperidinoethylideneamino)thieno[2,3-b]thiophene-5-carboxylate; piperidin-1-ium Formula: C26H32N4O3S2 MolecularWeight: 512.68728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=C(SC2=C1C(=C(S2)C(=O)C3=CC=CC=C3)N)C(=O)[O-])N4CCCCC4.C1CC[NH2+]CC1

Isomeric SMILES

CC(=NC1=C(SC2=C1C(=C(S2)C(=O)C3=CC=CC=C3)N)C(=O)[O-])N4CCCCC4.C1CC[NH2+]CC1

InChI

InChI=1S/C21H21N3O3S2.C5H11N/c1-12(24-10-6-3-7-11-24)23-16-14-15(22)18(17(25)13-8-4-2-5-9-13)28-21(14)29-19(16)20(26)27;1-2-4-6-5-3-1/h2,4-5,8-9H,3,6-7,10-11,22H2,1H3,(H,26,27);6H,1-5H2