(3S)-1-[3-azanyl-6-(5-methyl-1H-indol-3-yl)pyrazin-2-yl]piperidine-3-carbonitrile

Systemtic Name: (3S)-1-[3-azanyl-6-(5-methyl-1H-indol-3-yl)pyrazin-2-yl]piperidine-3-carbonitrile Openeye Name: (3S)-1-[3-amino-6-(5-methyl-1H-indol-3-yl)pyrazin-2-yl]piperidine-3-carbonitrile CAS Name: (3S)-1-[3-amino-6-(5-methyl-1H-indol-3-yl)-2-pyrazinyl]-3-piperidinecarbonitrile IUPAC Name: (3S)-1-[3-amino-6-(5-methyl-1H-indol-3-yl)pyrazin-2-yl]piperidine-3-carbonitrile Traditional Name: (3S)-1-[3-amino-6-(5-methyl-1H-indol-3-yl)pyrazin-2-yl]nipecotonitrile Formula: C19H20N6 MolecularWeight: 332.4023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC=C2C3=CN=C(C(=N3)N4CCCC(C4)C#N)N

Isomeric SMILES

CC1=CC2=C(C=C1)NC=C2C3=CN=C(C(=N3)N4CCC[C@@H](C4)C#N)N

InChI

InChI=1S/C19H20N6/c1-12-4-5-16-14(7-12)15(9-22-16)17-10-23-18(21)19(24-17)25-6-2-3-13(8-20)11-25/h4-5,7,9-10,13,22H,2-3,6,11H2,1H3,(H2,21,23)/t13-/m1/s1