N,N-diethyl-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]ethanamine

Systemtic Name: N,N-diethyl-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]ethanamine Openeye Name: N,N-diethyl-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]ethanamine CAS Name: N,N-diethyl-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)thio]ethanamine IUPAC Name: N,N-diethyl-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]ethanamine Traditional Name: diethyl-[2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)thio]ethyl]amine Formula: C21H25N3S MolecularWeight: 351.5083

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC2=CC=CC=C2N=C(C1)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCSC1=NC2=CC=CC=C2N=C(C1)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3S/c1-3-24(4-2)14-15-25-21-16-20(17-10-6-5-7-11-17)22-18-12-8-9-13-19(18)23-21/h5-13H,3-4,14-16H2,1-2H3