4-[4-[[4-azanyl-5-(4-pyrrolidin-1-ylphenyl)carbonyl-1,3-thiazol-2-yl]amino]phenyl]piperazine-1-carboxylate

Systemtic Name: 4-[4-[[4-azanyl-5-(4-pyrrolidin-1-ylphenyl)carbonyl-1,3-thiazol-2-yl]amino]phenyl]piperazine-1-carboxylate Openeye Name: 4-[4-[[4-amino-5-(4-pyrrolidin-1-ylbenzoyl)thiazol-2-yl]amino]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[[4-amino-5-[oxo-[4-(1-pyrrolidinyl)phenyl]methyl]-2-thiazolyl]amino]phenyl]-1-piperazinecarboxylate IUPAC Name: 4-[4-[[4-amino-5-(4-pyrrolidin-1-ylbenzoyl)-1,3-thiazol-2-yl]amino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[[4-amino-5-(4-pyrrolidinobenzoyl)thiazol-2-yl]amino]phenyl]piperazine-1-carboxylate Formula: C25H27N6O3S- MolecularWeight: 491.58528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C(=O)C3=C(N=C(S3)NC4=CC=C(C=C4)N5CCN(CC5)C(=O)[O-])N

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)C(=O)C3=C(N=C(S3)NC4=CC=C(C=C4)N5CCN(CC5)C(=O)[O-])N

InChI

InChI=1S/C25H28N6O3S/c26-23-22(21(32)17-3-7-19(8-4-17)29-11-1-2-12-29)35-24(28-23)27-18-5-9-20(10-6-18)30-13-15-31(16-14-30)25(33)34/h3-10H,1-2,11-16,26H2,(H,27,28)(H,33,34)/p-1