N-methyl-4-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]butan-2-amine hydrochloride

Systemtic Name: N-methyl-4-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]butan-2-amine hydrochloride Openeye Name: N-methyl-4-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]butan-2-amine hydrochloride CAS Name: N-methyl-4-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)thio]-2-butanamine hydrochloride IUPAC Name: N-methyl-4-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]butan-2-amine hydrochloride Traditional Name: methyl-[1-methyl-3-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)thio]propyl]amine hydrochloride Formula: C20H24ClN3S MolecularWeight: 373.94266

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCSC1=NC2=CC=CC=C2N=C(C1)C3=CC=CC=C3)NC.Cl

Isomeric SMILES

CC(CCSC1=NC2=CC=CC=C2N=C(C1)C3=CC=CC=C3)NC.Cl

InChI

InChI=1S/C20H23N3S.ClH/c1-15(21-2)12-13-24-20-14-19(16-8-4-3-5-9-16)22-17-10-6-7-11-18(17)23-20;/h3-11,15,21H,12-14H2,1-2H3;1H