5-methyl-3-[3-[(5-methyl-2-oxidanylidene-indol-3-yl)amino]propylamino]indol-2-one

Systemtic Name: 5-methyl-3-[3-[(5-methyl-2-oxidanylidene-indol-3-yl)amino]propylamino]indol-2-one Openeye Name: 5-methyl-3-[3-[(5-methyl-2-oxo-indol-3-yl)amino]propylamino]indol-2-one CAS Name: 5-methyl-3-[3-[(5-methyl-2-oxo-3-indolyl)amino]propylamino]-2-indolone IUPAC Name: 5-methyl-3-[3-[(5-methyl-2-oxoindol-3-yl)amino]propylamino]indol-2-one Traditional Name: 3-[3-[(2-keto-5-methyl-indol-3-yl)amino]propylamino]-5-methyl-indol-2-one Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=O)N=C2C=C1)NCCCNC3=C4C=C(C=CC4=NC3=O)C

Isomeric SMILES

CC1=CC2=C(C(=O)N=C2C=C1)NCCCNC3=C4C=C(C=CC4=NC3=O)C

InChI

InChI=1S/C21H20N4O2/c1-12-4-6-16-14(10-12)18(20(26)24-16)22-8-3-9-23-19-15-11-13(2)5-7-17(15)25-21(19)27/h4-7,10-11H,3,8-9H2,1-2H3,(H,22,24,26)(H,23,25,27)