diethyl-[3-[[(6S)-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]amino]propyl]azanium

Systemtic Name: diethyl-[3-[[(6S)-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]amino]propyl]azanium Openeye Name: diethyl-[3-[[(6S)-6-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]amino]propyl]ammonium CAS Name: diethyl-[3-[[(6S)-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[[(6S)-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]amino]propyl]azanium Traditional Name: diethyl-[3-[[(6S)-6-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]amino]propyl]ammonium Formula: C18H29N4S+ MolecularWeight: 333.51466

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC1=C2C3=C(CCC(C3)C)SC2=NC=N1

Isomeric SMILES

CC[NH+](CC)CCCNC1=C2C3=C(CC[C@@H](C3)C)SC2=NC=N1

InChI

InChI=1S/C18H28N4S/c1-4-22(5-2)10-6-9-19-17-16-14-11-13(3)7-8-15(14)23-18(16)21-12-20-17/h12-13H,4-11H2,1-3H3,(H,19,20,21)/p+1/t13-/m0/s1