[2-[4-(3-methyl-5-oxidanylidene-7H-imidazo[1,5-c]imidazol-6-yl)piperazin-1-yl]-2-oxidanylidene-1-thiophen-2-yl-ethyl]carbamic acid

Systemtic Name: [2-[4-(3-methyl-5-oxidanylidene-7H-imidazo[1,5-c]imidazol-6-yl)piperazin-1-yl]-2-oxidanylidene-1-thiophen-2-yl-ethyl]carbamic acid Openeye Name: [2-[4-(3-methyl-5-oxo-7H-imidazo[1,5-c]imidazol-6-yl)piperazin-1-yl]-2-oxo-1-(2-thienyl)ethyl]carbamic acid CAS Name: [2-[4-(3-methyl-5-oxo-7H-imidazo[1,5-c]imidazol-6-yl)-1-piperazinyl]-2-oxo-1-thiophen-2-ylethyl]carbamic acid IUPAC Name: [2-[4-(3-methyl-5-oxo-7H-imidazo[1,5-c]imidazol-6-yl)piperazin-1-yl]-2-oxo-1-thiophen-2-ylethyl]carbamic acid Traditional Name: [2-keto-2-[4-(5-keto-3-methyl-7H-imidaz[1,5-c]imidazol-6-yl)piperazino]-1-(2-thienyl)ethyl]carbamic acid Formula: C17H20N6O4S MolecularWeight: 404.4435

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2N1C(=O)N(C2)N3CCN(CC3)C(=O)C(C4=CC=CS4)NC(=O)O

Isomeric SMILES

CC1=NC=C2N1C(=O)N(C2)N3CCN(CC3)C(=O)C(C4=CC=CS4)NC(=O)O

InChI

InChI=1S/C17H20N6O4S/c1-11-18-9-12-10-22(17(27)23(11)12)21-6-4-20(5-7-21)15(24)14(19-16(25)26)13-3-2-8-28-13/h2-3,8-9,14,19H,4-7,10H2,1H3,(H,25,26)