1-azanyl-4-[3-[(phenylmethyl)amino]propylamino]butane-2-thiol

Systemtic Name: 1-azanyl-4-[3-[(phenylmethyl)amino]propylamino]butane-2-thiol Openeye Name: 1-amino-4-[3-(benzylamino)propylamino]butane-2-thiol CAS Name: 1-amino-4-[3-[(phenylmethyl)amino]propylamino]-2-butanethiol IUPAC Name: 1-amino-4-[3-(benzylamino)propylamino]butane-2-thiol Traditional Name: 1-amino-4-[3-(benzylamino)propylamino]butane-2-thiol Formula: C14H25N3S MolecularWeight: 267.4334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCCNCCC(CN)S

Isomeric SMILES

C1=CC=C(C=C1)CNCCCNCCC(CN)S

InChI

InChI=1S/C14H25N3S/c15-11-14(18)7-10-16-8-4-9-17-12-13-5-2-1-3-6-13/h1-3,5-6,14,16-18H,4,7-12,15H2