N-(3-azanylpropyl)-7-[[(cyanoamino)-(pyridin-4-ylamino)methylidene]amino]-N-cyclohexyloxy-heptanamide

Systemtic Name: N-(3-azanylpropyl)-7-[[(cyanoamino)-(pyridin-4-ylamino)methylidene]amino]-N-cyclohexyloxy-heptanamide Openeye Name: N-(3-aminopropyl)-7-[[(cyanoamino)-(4-pyridylamino)methylene]amino]-N-(cyclohexoxy)heptanamide CAS Name: N-(3-aminopropyl)-7-[[(cyanoamino)-(pyridin-4-ylamino)methylidene]amino]-N-cyclohexyloxyheptanamide IUPAC Name: N-(3-aminopropyl)-7-[[(cyanoamino)-(pyridin-4-ylamino)methylidene]amino]-N-cyclohexyloxyheptanamide Traditional Name: N-(3-aminopropyl)-7-[[(cyanoamino)-(4-pyridylamino)methylene]amino]-N-(cyclohexoxy)enanthamide Formula: C23H37N7O2 MolecularWeight: 443.58558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)ON(CCCN)C(=O)CCCCCCN=C(NC#N)NC2=CC=NC=C2

Isomeric SMILES

C1CCC(CC1)ON(CCCN)C(=O)CCCCCCN=C(NC#N)NC2=CC=NC=C2

InChI

InChI=1S/C23H37N7O2/c24-14-8-18-30(32-21-9-4-3-5-10-21)22(31)11-6-1-2-7-15-27-23(28-19-25)29-20-12-16-26-17-13-20/h12-13,16-17,21H,1-11,14-15,18,24H2,(H2,26,27,28,29)