methyl 3-[(4-chlorophenyl)carbamoylamino]-4-[4-(3-methyl-5-oxidanylidene-7H-imidazo[1,5-c]imidazol-6-yl)piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 3-[(4-chlorophenyl)carbamoylamino]-4-[4-(3-methyl-5-oxidanylidene-7H-imidazo[1,5-c]imidazol-6-yl)piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 3-[(4-chlorophenyl)carbamoylamino]-4-[4-(3-methyl-5-oxo-7H-imidazo[1,5-c]imidazol-6-yl)piperazin-1-yl]-4-oxo-butanoate CAS Name: 3-[[(4-chloroanilino)-oxomethyl]amino]-4-[4-(3-methyl-5-oxo-7H-imidazo[1,5-c]imidazol-6-yl)-1-piperazinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 3-[(4-chlorophenyl)carbamoylamino]-4-[4-(3-methyl-5-oxo-7H-imidazo[1,5-c]imidazol-6-yl)piperazin-1-yl]-4-oxobutanoate Traditional Name: 3-[(4-chlorophenyl)carbamoylamino]-4-keto-4-[4-(5-keto-3-methyl-7H-imidaz[1,5-c]imidazol-6-yl)piperazino]butyric acid methyl ester Formula: C22H26ClN7O5 MolecularWeight: 503.93874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2N1C(=O)N(C2)N3CCN(CC3)C(=O)C(CC(=O)OC)NC(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NC=C2N1C(=O)N(C2)N3CCN(CC3)C(=O)C(CC(=O)OC)NC(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H26ClN7O5/c1-14-24-12-17-13-29(22(34)30(14)17)28-9-7-27(8-10-28)20(32)18(11-19(31)35-2)26-21(33)25-16-5-3-15(23)4-6-16/h3-6,12,18H,7-11,13H2,1-2H3,(H2,25,26,33)