2-[6-(aminomethyl)-10-hexyl-phenothiazin-4-yl]ethanenitrile

Systemtic Name: 2-[6-(aminomethyl)-10-hexyl-phenothiazin-4-yl]ethanenitrile Openeye Name: 2-[6-(aminomethyl)-10-hexyl-phenothiazin-4-yl]acetonitrile CAS Name: 2-[6-(aminomethyl)-10-hexyl-4-phenothiazinyl]acetonitrile IUPAC Name: 2-[6-(aminomethyl)-10-hexylphenothiazin-4-yl]acetonitrile Traditional Name: 2-[6-(aminomethyl)-10-hexyl-phenothiazin-4-yl]acetonitrile Formula: C21H25N3S MolecularWeight: 351.5083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC(=C2SC3=C(C=CC=C31)CN)CC#N

Isomeric SMILES

CCCCCCN1C2=CC=CC(=C2SC3=C(C=CC=C31)CN)CC#N

InChI

InChI=1S/C21H25N3S/c1-2-3-4-5-14-24-18-10-6-8-16(12-13-22)20(18)25-21-17(15-23)9-7-11-19(21)24/h6-11H,2-5,12,14-15,23H2,1H3