3-(cycloheptylamino)-4-[1-(3-imidazol-1-ylpropyl)indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(cycloheptylamino)-4-[1-(3-imidazol-1-ylpropyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-(cycloheptylamino)-4-[1-(3-imidazol-1-ylpropyl)indol-3-yl]pyrrole-2,5-dione CAS Name: 3-(cycloheptylamino)-4-[1-[3-(1-imidazolyl)propyl]-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-(cycloheptylamino)-4-[1-(3-imidazol-1-ylpropyl)indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-(cycloheptylamino)-4-[1-(3-imidazol-1-ylpropyl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=C(C(=O)NC2=O)C3=CN(C4=CC=CC=C43)CCCN5C=CN=C5

Isomeric SMILES

C1CCCC(CC1)NC2=C(C(=O)NC2=O)C3=CN(C4=CC=CC=C43)CCCN5C=CN=C5

InChI

InChI=1S/C25H29N5O2/c31-24-22(23(25(32)28-24)27-18-8-3-1-2-4-9-18)20-16-30(21-11-6-5-10-19(20)21)14-7-13-29-15-12-26-17-29/h5-6,10-12,15-18H,1-4,7-9,13-14H2,(H2,27,28,31,32)