2-methyl-3-[(E)-[2-oxidanylidene-1-(piperazin-1-ylmethyl)indol-3-ylidene]amino]quinazolin-4-one

Systemtic Name: 2-methyl-3-[(E)-[2-oxidanylidene-1-(piperazin-1-ylmethyl)indol-3-ylidene]amino]quinazolin-4-one Openeye Name: 2-methyl-3-[(E)-[2-oxo-1-(piperazin-1-ylmethyl)indolin-3-ylidene]amino]quinazolin-4-one CAS Name: 2-methyl-3-[(E)-[2-oxo-1-(1-piperazinylmethyl)-3-indolylidene]amino]-4-quinazolinone IUPAC Name: 2-methyl-3-[(E)-[2-oxo-1-(piperazin-1-ylmethyl)indol-3-ylidene]amino]quinazolin-4-one Traditional Name: 3-[(E)-[2-keto-1-(piperazinomethyl)indolin-3-ylidene]amino]-2-methyl-quinazolin-4-one Formula: C22H22N6O2 MolecularWeight: 402.44908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1N=C3C4=CC=CC=C4N(C3=O)CN5CCNCC5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1/N=C/3\C4=CC=CC=C4N(C3=O)CN5CCNCC5

InChI

InChI=1S/C22H22N6O2/c1-15-24-18-8-4-2-6-16(18)21(29)28(15)25-20-17-7-3-5-9-19(17)27(22(20)30)14-26-12-10-23-11-13-26/h2-9,23H,10-14H2,1H3/b25-20+