5-[1-(4-azanylbutyl)indol-3-yl]-3-methyl-2-oxidanylidene-1-(1-propylindol-3-yl)imidazole-4-carbonitrile

Systemtic Name: 5-[1-(4-azanylbutyl)indol-3-yl]-3-methyl-2-oxidanylidene-1-(1-propylindol-3-yl)imidazole-4-carbonitrile Openeye Name: 5-[1-(4-aminobutyl)indol-3-yl]-3-methyl-2-oxo-1-(1-propylindol-3-yl)imidazole-4-carbonitrile CAS Name: 5-[1-(4-aminobutyl)-3-indolyl]-3-methyl-2-oxo-1-(1-propyl-3-indolyl)-4-imidazolecarbonitrile IUPAC Name: 5-[1-(4-aminobutyl)indol-3-yl]-3-methyl-2-oxo-1-(1-propylindol-3-yl)imidazole-4-carbonitrile Traditional Name: 5-[1-(4-aminobutyl)indol-3-yl]-2-keto-3-methyl-1-(1-propylindol-3-yl)-4-imidazoline-4-carbonitrile Formula: C28H30N6O MolecularWeight: 466.5774

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=CC=CC=C21)N3C(=C(N(C3=O)C)C#N)C4=CN(C5=CC=CC=C54)CCCCN

Isomeric SMILES

CCCN1C=C(C2=CC=CC=C21)N3C(=C(N(C3=O)C)C#N)C4=CN(C5=CC=CC=C54)CCCCN

InChI

InChI=1S/C28H30N6O/c1-3-15-32-19-26(21-11-5-7-13-24(21)32)34-27(25(17-30)31(2)28(34)35)22-18-33(16-9-8-14-29)23-12-6-4-10-20(22)23/h4-7,10-13,18-19H,3,8-9,14-16,29H2,1-2H3