N,N-diethyl-3-[(4-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]propan-1-amine; ethanedioic acid

Systemtic Name: N,N-diethyl-3-[(4-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]propan-1-amine; ethanedioic acid Openeye Name: N,N-diethyl-3-[(4-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]propan-1-amine; oxalic acid CAS Name: N,N-diethyl-3-[(4-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]-1-propanamine; oxalic acid IUPAC Name: N,N-diethyl-3-[(4-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]propan-1-amine; oxalic acid Traditional Name: diethyl-[3-[(4-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]propyl]amine; oxalic acid Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN=C1C2=C(C(=CC=C2)C)SCC3=CC=CC=C31.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CCCN=C1C2=C(C(=CC=C2)C)SCC3=CC=CC=C31.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H28N2S.C2H2O4/c1-4-24(5-2)15-9-14-23-21-19-12-7-6-11-18(19)16-25-22-17(3)10-8-13-20(21)22;3-1(4)2(5)6/h6-8,10-13H,4-5,9,14-16H2,1-3H3;(H,3,4)(H,5,6)