N-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]-2-chloranyl-quinoline-4-carboxamide

Systemtic Name: N-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]-2-chloranyl-quinoline-4-carboxamide Openeye Name: N-(4-carbamoyl-5-ureido-2-thienyl)-2-chloro-quinoline-4-carboxamide CAS Name: N-[4-carbamoyl-5-(carbamoylamino)-2-thiophenyl]-2-chloro-4-quinolinecarboxamide IUPAC Name: N-[4-carbamoyl-5-(carbamoylamino)thiophen-2-yl]-2-chloroquinoline-4-carboxamide Traditional Name: N-(4-carbamoyl-5-ureido-2-thienyl)-2-chloro-cinchoninamide Formula: C16H12ClN5O3S MolecularWeight: 389.81618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)Cl)C(=O)NC3=CC(=C(S3)NC(=O)N)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)Cl)C(=O)NC3=CC(=C(S3)NC(=O)N)C(=O)N

InChI

InChI=1S/C16H12ClN5O3S/c17-11-5-8(7-3-1-2-4-10(7)20-11)14(24)21-12-6-9(13(18)23)15(26-12)22-16(19)25/h1-6H,(H2,18,23)(H,21,24)(H3,19,22,25)