[4-(dipropylamino)phenyl]-piperazin-4-ium-1-yl-methanethione

Systemtic Name: [4-(dipropylamino)phenyl]-piperazin-4-ium-1-yl-methanethione Openeye Name: [4-(dipropylamino)phenyl]-piperazin-4-ium-1-yl-methanethione CAS Name: [4-(dipropylamino)phenyl]-(1-piperazin-4-iumyl)methanethione IUPAC Name: [4-(dipropylamino)phenyl]-piperazin-4-ium-1-ylmethanethione Traditional Name: [4-(dipropylamino)phenyl]-piperazin-4-ium-1-yl-methanethione Formula: C17H28N3S+ MolecularWeight: 306.48932

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=CC=C(C=C1)C(=S)N2CC[NH2+]CC2

Isomeric SMILES

CCCN(CCC)C1=CC=C(C=C1)C(=S)N2CC[NH2+]CC2

InChI

InChI=1S/C17H27N3S/c1-3-11-19(12-4-2)16-7-5-15(6-8-16)17(21)20-13-9-18-10-14-20/h5-8,18H,3-4,9-14H2,1-2H3/p+1